SCHEMBL13627580

SCHEMBL13627580

CCNCCCOc1cc2nccc(Sc3ccc(NC(=O)Nc4ccc(F)cc4)s3)c2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 9/20 0.51
KDR P35968 9/20 0.51
MET P08581 11/20 0.49
AXL P30530 3/20 0.49
HDAC1 Q13547 2/20 0.42
RET P07949 1/20 0.41
PDGFRB P09619 1/20 0.41
KIT P10721 1/20 0.41
FLT3 P36888 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL1894791 0.90 PDGFRA (0.61) PDGFRAKDRMETAXLRET
SCHEMBL12411845 0.89 KDR (0.50) PDGFRAKDRMETAXLHDAC1
SCHEMBL13627231 0.89 PDGFRA (0.50) PDGFRAKDRMETAXLHDAC1
SCHEMBL1891121 0.89 KDR (0.51) PDGFRAKDRMETAXLHDAC1
SCHEMBL1893428 0.82 KDR (0.51) PDGFRAKDRMETAXLRET
SCHEMBL1898468 0.82 PDGFRA (0.59) PDGFRAKDRMETAXL
SCHEMBL1897126 0.81 KDR (0.61) PDGFRAKDRMETHDAC1
SCHEMBL1897152 0.81 KDR (0.60) PDGFRAKDRMET
SCHEMBL1890686 0.80 MET (0.44) PDGFRAKDRMETAXLPDGFRB
SCHEMBL12663982 0.79 KDR (0.45) PDGFRAKDRMETAXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612092-B2 Urea derivatives containing aromatic or heteroaromatic rings; 4-(3-chloro-4-(cyclopropylaminocarbonyl)aminophenoxy)-7-methoxy-6-quinolinecarboxamide; prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed