SCHEMBL7466533

SCHEMBL7466533

Cc1cc(NC(=O)c2c[nH]nc2C)ccc1C(F)(F)F.Cc1n[nH]cc1C(=O)Nc1ccc(S(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 4/20 0.44
KDR P35968 4/20 0.44
RXFP1 Q9HBX9 9/20 0.41
KIF11 P52732 1/20 0.40
HTR2A P28223 1/20 0.39
TSPO P30536 1/20 0.39
GPR183 P32249 1/20 0.39
APLNR P35414 1/20 0.39
TRPV1 Q8NER1 2/20 0.39
AVPR2 P30518 1/20 0.38
GPR27 Q9NS67 1/20 0.38
CNR2 P34972 1/20 0.38
P2RX1 P51575 1/20 0.37

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
SCHEMBL6707885 0.89 KIF11 (0.48) RXFP1KIF11HTR2ATSPOGPR183
SCHEMBL6709302 0.89 FLT1 (0.51) FLT1KDRRXFP1
SCHEMBL6708053 0.76 FLT1 (0.46) FLT1KDRRXFP1P2RX1
SCHEMBL6707907 0.76 FLT1 (0.45) FLT1KDR
SCHEMBL6707219 0.75 SMN1; SMN2 (0.56) FLT1KDRHTR2ATRPV1P2RX1
SCHEMBL6707083 0.74 KIF11 (0.43) RXFP1KIF11HTR2ATSPOGPR183
SCHEMBL6709110 0.72 KIF11 (0.43) RXFP1KIF11HTR2ATSPOGPR183
SCHEMBL29458439 0.71 MEN1 (0.55) FLT1KDRTRPV1
SCHEMBL6709304 0.69 KIF11 (0.48) RXFP1KIF11HTR2ATRPV1P2RX1
SCHEMBL6707284 0.69 FLT1 (0.51) FLT1KDRRXFP1HTR2ATRPV1

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
EP-1012150-A4 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN INC (US) 2002-05-29 EP disclosed
EP-1012150-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS Sugen, Inc. (US) 2000-06-28 EP disclosed
WO-1998052944-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN, INC. (US) 1998-11-26 WO disclosed