SCHEMBL169035

SCHEMBL169035

Cc1ccc(Oc2cccnc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
TDP1 Q9NUW8 3/20 0.62
CYP19A1 P11511 3/20 0.61
LTA4H P09960 2/20 0.54
CYP11B1 P15538 1/20 0.53
CYP11B2 P19099 1/20 0.53
KMT2A Q03164 2/20 0.51
MMP13 P45452 1/20 0.51
ALDH1A1 P00352 4/20 0.48
HTT P42858 3/20 0.47
TEAD4 Q15561 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL16114401 0.89 LMNA (0.75) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL27968872 0.85 LMNA (0.69) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL30535283 0.85 LMNA (0.82) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL676142 0.85 LMNA (0.82) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL11107948 0.84 LMNA (0.62) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL21345924 0.83 CYP3A4 (0.57) CYP19A1LTA4HCYP11B1CYP11B2KMT2A
SCHEMBL29500180 0.83 LMNA (0.72) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL78141 0.83 LMNA (0.72) LMNATDP1CYP19A1LTA4HCYP11B1
Potassium SCHEMBL6776357 0.83 LMNA (0.78) LMNATDP1CYP19A1LTA4HCYP11B1
SCHEMBL20176876 0.82 LMNA (0.60) LMNATDP1CYP19A1LTA4HCYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102149677-A Biaryl aminotetralines HOFFMANN LA ROCHE 2011-08-10 CN claimed
EP-3326715-B1 OXALIC ACID MONOAMIDE LIGAND, AND USES THEREOF IN COUPLING REACTION OF COPPER-CATALYZED ARYL HALOGEN SUBSTITUTE CE PHARM CO LTD (CN) 2021-09-15 EP disclosed
EP-3808740-A1 ORAL DOSAGE FORMS COMPRISING 4-PHENYL-6-(2,2,2-TRIFLUORO-1-PHENYLETHOXY)PYRIMIDINE-BASED COMPOUNDS AND METHODS OF THEIR USE TerSera Therapeutics LLC (US) 2021-04-21 EP disclosed
WO-2020255020-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PD-L1 INHIBITORS Janssen Sciences Ireland Unlimited Company (IE) 2020-12-24 WO disclosed
WO-2020245372-A1 HETEROCYCLIC IMMUNOMODULATORS AS PDL1 CHECKPOINT INHIBITOR Janssen Sciences Ireland Unlimited Company (IE) 2020-12-10 WO disclosed
EP-3176159-B1 4-PHENYL-6-(2,2,2-TRIFLUORO-1-PHENYLETHOXY)PYRIMIDINE-BASED COMPOUNDS AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS INC (US) 2020-10-21 EP disclosed
WO-2020141439-A1 HETEROCYCLIC COMPOUNDS AS MUTANT IDH INHIBITORS INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2020-07-09 WO disclosed
US-20190352276-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE JOINT STOCK COMPANY "BIOCAD" (RU) 2019-11-21 US disclosed
EP-3549934-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2019-10-09 EP disclosed
WO-2019173507-A1 ANTIBACTERIAL AGENTS : ARYLALKYLCARBOXAMIDO PHLOROGLUCINOLS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-09-12 WO disclosed
US-20070093532-A1 Benzimidazole carboxamides as raf kinase inhibitors MERCK PATENT GMBH (DE) 2007-04-26 US disclosed
US-20070093532-A1 Benzimidazole carboxamides as raf kinase inhibitors MERCK PATENT GMBH (DE) 2007-04-26 US disclosed
US-20070093529-A1 Diacylhydrazine derivatives MERCK PATENT GMBH (DE) 2007-04-26 US disclosed
US-20070055065-A1 N-sulphonylated amino acid derivatives, method for the production and use thereof CURACYTE CHEMISTRY GMBH (DE) 2007-03-08 US disclosed
US-20070055065-A1 N-sulphonylated amino acid derivatives, method for the production and use thereof CURACYTE CHEMISTRY GMBH (DE) 2007-03-08 US disclosed
US-7176204-B2 Substituted carboxylic acid derivatives KYORIN PAHRMACEUTICAL CO., LTD. (JP) 2007-02-13 US disclosed
US-7176204-B2 Substituted carboxylic acid derivatives KYORIN PAHRMACEUTICAL CO., LTD. (JP) 2007-02-13 US disclosed
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis MERCK PATENT GMBH (DE) 2007-01-11 US disclosed
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis MERCK PATENT GMBH (DE) 2007-01-11 US disclosed
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 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 (5 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-20070093532-A1 Benzimidazole carboxamides as raf kinase inhibitors BRAF, RAF1, ARAF LMNA 2964/4885TDP1 2653/4885CYP19A1 2859/4885
US-20070055065-A1 N-sulphonylated amino acid derivatives, method for the production and use thereof DNPEP, ANPEP, PEPD LMNA 854/4885TDP1 2326/4885CYP19A1 1562/4885
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis BRAF, RAF1, VEGFA LMNA 3781/4885TDP1 3048/4885CYP19A1 1832/4885
US-20070093529-A1 Diacylhydrazine derivatives BRAF, RAF1, NRAS LMNA 3800/4885TDP1 1410/4885CYP19A1 1085/4885
US-20190352276-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, ABL1, CNKSR1 LMNA 946/4885TDP1 1826/4885CYP19A1 2835/4885

“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.