SCHEMBL1233760

SCHEMBL1233760

NCCc1[nH]nc2cnc3ccccc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.37
KDM4E B2RXH2 1/20 0.36
GPR3 P46089 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 1/20 0.35
NOS1 P29475 1/20 0.35
FERMT2 Q96AC1 1/20 0.35
PBRM1 Q86U86 2/20 0.33
ILK Q13418 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PDK1 Q15118 1/20 0.33
AKT1 P31749 2/20 0.33
PDPK1 O15530 1/20 0.33
ACHE P22303 1/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
MPO P05164 1/20 0.32

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
SCHEMBL1233271 0.79 PDE1A (0.43) KDM4EGPR3CYP1A2CYP2C19NOS1
SCHEMBL1233826 0.78 KDM4E (0.33) LOXL2KDM4EGPR3CYP1A2CYP2C19
SCHEMBL1897984 0.76 KMT2A (0.43) KDM4EGPR3CYP1A2CYP2C19NOS1
SCHEMBL728920 0.72 ERN1 (0.45) KDM4EGPR3CYP1A2CYP2C19NOS1
SCHEMBL1233757 0.70 KDM4E (0.36) KDM4EGPR3CYP1A2CYP2C19NOS1
SCHEMBL1233822 0.67 KDM4E (0.33) KDM4EGPR3CYP1A2CYP2C19NOS1
SCHEMBL6223283 0.63 LOXL2 (0.71) LOXL2KDM4ECYP1A2FERMT2MPO
SCHEMBL2719830 0.62 LOXL2 (0.42) LOXL2KDM4EGPR3CYP1A2CYP2C19
SCHEMBL2721134 0.62 PRKAA2 (0.40) LOXL2KDM4ECYP1A2CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL27136608 0.62 PDE10A (0.42) PDE10A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696912-B1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-05-11 EP disclosed
US-9145410-B2 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-09-29 US disclosed
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2012-05-17 US disclosed
US-7879849-B2 such as 1-(2-Methylpropyl)-2-propyl-2H-pyrazolo[3,4-c]quinolin-4-amine, used as immunomodulators, for inducing or inhibiting cytokine biosynthesis in animals and in the treatment of viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-02-01 US disclosed
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2009-12-24 US disclosed
US-7544697-B2 Pyrazolopyridines and analogs thereof COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-06-09 US disclosed
EP-1696912-A4 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2009-06-03 EP disclosed
US-20090075980-A1 Pyrazolopyridines and Analogs Thereof COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-03-19 US disclosed
EP-1863809-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-12 EP disclosed
WO-2006107753-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO disclosed
EP-1696912-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M Innovative Properties Company (US) 2006-09-06 EP disclosed
US-20060100229-A1 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY 2006-05-11 US disclosed
WO-2005079195-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-09-01 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-20090075980-A1 Pyrazolopyridines and Analogs Thereof IL4, IL4I1, IL2 LOXL2 4588/4885KDM4E 1465/4885GPR3 1703/4885
US-20060100229-A1 Pyrazolopyridines and analogs thereof IL4, IL2, IL4I1 LOXL2 4633/4885KDM4E 1735/4885GPR3 1884/4885
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL4I1, IL2 LOXL2 4588/4885KDM4E 1465/4885GPR3 1703/4885
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 LOXL2 4633/4885KDM4E 1735/4885GPR3 1884/4885

“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.