SCHEMBL6744863

SCHEMBL6744863

Cc1cccc2c1/C(=C/c1ccc3[nH]ccc3c1)C(=O)N2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.59
KDR P35968 2/20 0.57
PDPK1 O15530 2/20 0.57
PDGFRB P09619 4/20 0.52
ERBB2 P04626 2/20 0.52
IGF1R P08069 1/20 0.50
FLT3 P36888 1/20 0.45
EGFR P00533 1/20 0.44
FGFR1 P11362 1/20 0.44
CDK2 P24941 1/20 0.44
CYP2A6 P11509 1/20 0.43
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
PLK4 O00444 1/20 0.38
PLK1 P53350 1/20 0.38
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36

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
SCHEMBL6744866 1.00 RET (0.59) RETKDRPDPK1PDGFRBERBB2
SCHEMBL6740947 0.81 CDK2 (0.49) RETKDRPDPK1PDGFRBERBB2
SCHEMBL6740946 0.81 CDK2 (0.49) RETKDRPDPK1PDGFRBERBB2
SCHEMBL5473028 0.80 PDGFRB (0.57) RETKDRPDPK1PDGFRBERBB2
SCHEMBL5473025 0.80 PDGFRB (0.57) RETKDRPDPK1PDGFRBERBB2
SCHEMBL6409193 0.75 RET (0.58) RETPDPK1FLT3CYP2A6PLK4
SCHEMBL6409195 0.75 RET (0.58) RETPDPK1FLT3CYP2A6PLK4
SCHEMBL29699386 0.74 RET (0.60) RETKDRPDPK1PDGFRBERBB2
SCHEMBL4987607 0.74 KDR (0.48) RETKDRPDPK1PDGFRBERBB2
SCHEMBL4987602 0.74 KDR (0.48) RETKDRPDPK1PDGFRBERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689806-B1 MODULATING PROTEIN KINASES AND RELATED SIGNAL TRANSDUCTION PATHWAYS SUGEN, INC. 2004-02-10 US disclosed
EP-1165513-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS Sugen, Inc. (US) 2002-01-02 EP disclosed
WO-2000056709-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS SUGEN, INC. (US) 2000-09-28 WO disclosed