SCHEMBL4490746

SCHEMBL4490746

COc1ccnc(Cl)c1C(=O)Nc1ccc(F)cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2C19 P33261 2/20 0.56
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.55
KDM4E B2RXH2 1/20 0.53
KDR P35968 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
PDGFRA P16234 5/20 0.52
KIT P10721 1/20 0.52
FGFR2 P21802 1/20 0.52
AXL P30530 1/20 0.52
S1PR3 Q99500 1/20 0.51

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
SCHEMBL4488778 0.83 S1PR3 (0.52) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL4483530 0.76 THRB (0.53) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL1585188 0.74 PSEN1 (0.48) NPC1ALDH1A1HPGDKMT2ALMNA
SCHEMBL11907694 0.74 PSEN1 (0.48) NPC1ALDH1A1HPGDKMT2ALMNA
SCHEMBL32670789 0.74 MAPT (0.56) CYP1A2CYP2C19RAB9ANPC1ALDH1A1
SCHEMBL29395986 0.74 MAPT (0.56) CYP1A2CYP2C19RAB9ANPC1ALDH1A1
SCHEMBL4493780 0.74 MAPT (0.56) CYP1A2CYP2C19RAB9ANPC1ALDH1A1
SCHEMBL15333128 0.73 CYP1A2 (0.65) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL30739855 0.73 CYP1A2 (0.65) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL1585189 0.73 TAAR1 (0.55) RAB9ANPC1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937682-B1 MET KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-08-12 EP disclosed
US-7547782-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-16 US disclosed
US-7547782-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-16 US disclosed
US-7547782-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-16 US disclosed
WO-2007041379-A1 MET KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-12 WO disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US 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 (1 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-20070078140-A1 MET kinase inhibitors MET, ABL1, ERBB2 CYP1A2 2556/4885CYP3A4 2690/4885CYP2C19 2122/4885

“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.