SCHEMBL3179740

SCHEMBL3179740

COc1ccc(-c2c(C)n[nH]c2N)c(C)n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.44
PDE10A Q9Y233 1/20 0.44
NNMT P40261 1/20 0.41
TACR2 P21452 1/20 0.36
CRHR1 P34998 1/20 0.36
BRD9 Q9H8M2 1/20 0.35
BRD7 Q9NPI1 1/20 0.35
CHEK1 O14757 1/20 0.34
AKT2 P31751 1/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14591633 0.87 PDE2A (0.52) PDE2APDE10ANNMTTACR2CRHR1
SCHEMBL2402669 0.74 DRD1 (0.47)
SCHEMBL13480610 0.74 PDE2A (0.36) PDE2APDE10ANNMTTACR2CRHR1
SCHEMBL5730488 0.73 ALDH1A1 (0.57)
SCHEMBL13516427 0.72 MAPT (0.50)
SCHEMBL14350130 0.72 GAA (0.45)
SCHEMBL1868350 0.72 HSP90AA1 (0.48) CRHR1
SCHEMBL17164736 0.69 NNMT (0.40) PDE10ANNMTTACR2CRHR1BRD9
SCHEMBL21116462 0.69 ALDH1A1 (0.45) PDE2APDE10ANNMTBRD9BRD7
SCHEMBL3206424 0.69 ALPL (0.42) CHEK1AKT2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662817-B2 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-16 US disclosed
US-7662817-B2 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-16 US disclosed
US-7662817-B2 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-16 US disclosed
CN-100427093-C 4(2-butylamino)-2,7-dimethyl-8-(2-methyl(-6-methoxyp-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine as corticotropin releasing factor receptor BRISTOL MYERS SQUIBB PHARMA CO (US) 2008-10-22 CN disclosed
US-20080139567-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-06-12 US disclosed
US-20080139567-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-06-12 US disclosed
US-20080139567-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-06-12 US disclosed
US-7358252-B2 4-(2-butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-04-15 US disclosed
US-7358252-B2 4-(2-butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-04-15 US disclosed
US-7358252-B2 4-(2-butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-04-15 US disclosed
US-20070054913-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY 2007-03-08 US disclosed
US-20070054913-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY 2007-03-08 US disclosed
EP-1368094-B1 4-(2-BUTYLAMINO)-2,7-DIMETHYL-8-(2-METHYL-6-METHOXYPYRID-3-YL) PYRAZOLO- 1,5-A|-1,3,5-TRIAZINE, ITS ENANTIOMERS AND PHARMACEUTICALLY ACCEPTABLE SALTS AS CORTICOTROPIN RELEASING FACTOR RECEPTOR LIGANDS BRISTOL MYERS SQUIBB PHARMA CO (US) 2007-02-28 EP disclosed
US-7157578-B2 4-(2-butylamino)-2, 7-dimethyl-8-(2-methyl-6-methoxypyrid-3-YL) pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-01-02 US disclosed
CN-1509196-A 4(2-butylamino)-2,7-dimethyl-8-(2-methyl(-6-methoxyp-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine as corticotropin releasing factor receptor ����˹�ж�-����˹˹����ҩƷ��˾ 2004-06-30 CN disclosed
EP-1368094-A4 4-(2-BUTYLAMINO)-2,7-DIMETHYL-8-(2-METHYL-6-METHOXYPYRID-3-YL) PYRAZOLO- 1,5-A]-1,3,5-TRIAZINE, ITS ENANTIOMERS AND PHARMACEUTICALLY ACCEPTABLE SALTS AS CORTICOTROPIN RELEASING FACTOR RECEPTOR LIGANDS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-03-31 EP disclosed
US-20040014760-A1 4- (2-butylamino) -2, 7-dimethyl-8- (2-methyl-6-methoxypyrid-3-YL) pyrazolo- [1,5-A] -1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands GILLIGAN PAUL J (US) 2004-01-22 US disclosed
EP-1368094-A1 4-(2-BUTYLAMINO)-2,7-DIMETHYL-8-(2-METHYL-6-METHOXYPYRID-3-YL) PYRAZOLO- 1,5-A]-1,3,5-TRIAZINE, ITS ENANTIOMERS AND PHARMACEUTICALLY ACCEPTABLE SALTS AS CORTICOTROPIN RELEASING FACTOR RECEPTOR LIGANDS Bristol-Myers Squibb Pharma Company (US) 2003-12-10 EP disclosed
US-20030125330-A1 4 - (2-butylamino) - 2, 7-dimethyl-8- (2-methyl-6-methoxypyrid-3-yl) pyrazolo- [1,5-A] - 1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (FORMERLY D/B/A DUPONT PHARMACEUTICALS COMPANY) 2003-07-03 US disclosed
WO-2002072202-A1 4-(2-BUTYLAMINO)-2,7-DIMETHYL-8-(2-METHYL-6-METHOXYPYRID-3-YL) PYRAZOLO-[1,5-A]-1,3,5-TRIAZINE, ITS ENANTIOMERS AND PHARMACEUTICALLY ACCEPTABLE SALTS AS CORTICOTROPIN RELEASING FACTOR RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-09-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070054913-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-a]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands CRHR2, CRH, CRHR1 PDE2A 879/4885PDE10A 1705/4885NNMT 4756/4885
US-20080139567-A1 4-(2-Butylamino)-2,7-dimethyl-8-(2-methyl-6-methoxypyrid-3-yl)pyrazolo-[1,5-A]-1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands CRHR2, CRH, CRHR1 PDE2A 879/4885PDE10A 1705/4885NNMT 4756/4885
US-20030125330-A1 4 - (2-butylamino) - 2, 7-dimethyl-8- (2-methyl-6-methoxypyrid-3-yl) pyrazolo- [1,5-A] - 1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands CRHR2, CRH, CRHR1 PDE2A 970/4885PDE10A 1872/4885NNMT 4773/4885
US-20040014760-A1 4- (2-butylamino) -2, 7-dimethyl-8- (2-methyl-6-methoxypyrid-3-YL) pyrazolo- [1,5-A] -1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands CRHR2, CRH, CRHR1 PDE2A 970/4885PDE10A 1872/4885NNMT 4773/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.