SCHEMBL16360396

SCHEMBL16360396

O=C(O)c1ccc(S(=O)(=O)c2ccc(C3Cc4cnc(NCCCN5CCCC5)nc4-c4ccccc43)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 8/20 0.41
FGFR2 P21802 3/20 0.41
CSNK2A1 P68400 3/20 0.40
MALT1 Q9UDY8 1/20 0.37
S100A4 P26447 1/20 0.35
EGFR P00533 2/20 0.35
FGFR4 P22455 2/20 0.35
FGFR3 P22607 2/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35
SFRP1 Q8N474 1/20 0.35

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
SCHEMBL2802673 0.93 FGFR1 (0.43) FGFR1FGFR2CSNK2A1EGFR
SCHEMBL2802954 0.87 FGFR1 (0.54) FGFR1FGFR2MALT1S100A4EGFR
SCHEMBL2804612 0.86 FGFR1 (0.53) FGFR1FGFR2MALT1S100A4
SCHEMBL2803907 0.86 FGFR1 (0.53) FGFR1FGFR2MALT1S100A4
SCHEMBL2806026 0.85 CHRNA7 (0.47) FGFR1FGFR2
SCHEMBL2802057 0.85 FGFR1 (0.48) FGFR1FGFR2MALT1S100A4
SCHEMBL2802254 0.85 FGFR1 (0.49) FGFR1FGFR2EGFRFGFR4FGFR3
SCHEMBL2806559 0.83 FGFR1 (0.45) FGFR1FGFR2MALT1S100A4EGFR
SCHEMBL2489256 0.83 FGFR1 (0.50) FGFR1FGFR2MALT1S100A4EGFR
SCHEMBL2803937 0.83 FGFR1 (0.45) FGFR1FGFR2MALT1EGFRFGFR4

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
WO-2010078421-A1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F] ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE, INC. (US) 2010-07-08 WO disclosed