SCHEMBL2879534

SCHEMBL2879534

Nc1ccc(Oc2ccnc3c2CCN3)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.48
AXL P30530 2/20 0.48
BRD4 O60885 2/20 0.35
ROCK2 O75116 9/20 0.35
CYP3A4 P08684 1/20 0.33
RET P07949 1/20 0.33
KIT P10721 1/20 0.33
PDGFRA P16234 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
TRPA1 O75762 1/20 0.32
BRD2 P25440 1/20 0.32
BRD3 Q15059 1/20 0.32
BRDT Q58F21 1/20 0.32
CREBBP Q92793 1/20 0.32
HTR1A P08908 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
AURKA O14965 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
SCHEMBL15553028 0.82 MET (0.51) METAXLBRD4RETKIT
SCHEMBL29814288 0.80 AXL (0.39) METAXLBRD4RETKIT
SCHEMBL17230362 0.80 AXL (0.39) METAXLBRD4RETKIT
SCHEMBL17222173 0.79 AXL (0.40) METAXLBRD4ROCK2CYP3A4
SCHEMBL15541495 0.79 AXL (0.36) METAXLROCK2CYP3A4RET
SCHEMBL9905781 0.78 BRAF (0.50) METAXLBRD4ROCK2RET
SCHEMBL15555430 0.77 AXL (0.35) METAXLBRD4ROCK2CYP3A4
SCHEMBL15554272 0.77 AXL (0.39) METAXLBRD4ROCK2CYP3A4
SCHEMBL2879901 0.76 MET (0.50) METAXLROCK2CYP3A4RET
SCHEMBL2884105 0.75 MET (0.44) METAXLROCK2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9617257-B2 Fused pyridine derivatives useful as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2017-04-11 US claimed
US-20150315210-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO., LTD. (CN) 2015-11-05 US claimed
EP-2867223-B1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO LTD (CN) 2018-09-05 EP disclosed
US-9617257-B2 Fused pyridine derivatives useful as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2017-04-11 US disclosed
US-9617257-B2 Fused pyridine derivatives useful as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2017-04-11 US disclosed
US-9617257-B2 Fused pyridine derivatives useful as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2017-04-11 US disclosed
US-20150315210-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO., LTD. (CN) 2015-11-05 US disclosed
US-20150315210-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO., LTD. (CN) 2015-11-05 US disclosed
US-20150315210-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO., LTD. (CN) 2015-11-05 US disclosed
EP-2867223-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS Betta Pharmaceuticals Co., Ltd. (CN) 2015-05-06 EP disclosed
WO-2014000713-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS ZHEJIANG BETA PHARMA INCORPORATION (CN) 2014-01-03 WO disclosed
US-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-20060241127-A1 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER HEALTHCARE AG (DE) 2006-10-26 US disclosed
EP-1562935-B1 HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2006-09-06 EP disclosed
EP-1562935-A1 HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS Bayer HealthCare AG (DE) 2005-08-17 EP disclosed
WO-2004039796-A1 HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2004-05-13 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 (2 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-20150315210-A1 NOVEL FUSED PYRIDINE DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS MET, ABL1, ROS1 MET 1/4885AXL 172/4885BRD4 824/4885
US-20060241127-A1 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors ROCK1, ROCK2, RHOA MET 1035/4885AXL 2231/4885BRD4 1073/4885

“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.