SCHEMBL13627231

SCHEMBL13627231

CCNCCCOc1cc2nccc(Sc3ncc(NC(=O)Nc4ccc(F)cc4)s3)c2cc1OC

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 8/20 0.50
KDR P35968 8/20 0.50
MET P08581 9/20 0.47
AXL P30530 3/20 0.47
FLT3 P36888 3/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
RET P07949 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC1 Q13547 2/20 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
SCHEMBL1891719 0.90 PDGFRA (0.60) PDGFRAKDRMETAXL
SCHEMBL1897599 0.89 KDR (0.49) PDGFRAKDRMETAXLFLT3
SCHEMBL13627580 0.89 PDGFRA (0.51) PDGFRAKDRMETAXLFLT3
SCHEMBL12673766 0.82 KDR (0.61) PDGFRAKDR
SCHEMBL1893098 0.82 KDR (0.60) PDGFRAKDR
SCHEMBL1893240 0.82 KDR (0.60) PDGFRAKDR
SCHEMBL1893004 0.81 PDGFRA (0.59) PDGFRAKDRMETAXL
SCHEMBL14693163 0.81 PDGFRA (0.58) PDGFRAKDR
SCHEMBL1888598 0.80 KDR (0.60) PDGFRAKDRMETAXLRET
SCHEMBL12664002 0.79 KDR (0.44) PDGFRAKDRMET

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