SCHEMBL1018900

SCHEMBL1018900

Cc1ccc(S(=O)(=O)n2ccc3c(NC(C)CO)nc(Nc4ccc(N5CCN(CC=O)CC5)cc4)nc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 10/20 0.42
SYK P43405 2/20 0.41
FLT3 P36888 1/20 0.39
CDK1 P06493 3/20 0.38
KDR P35968 3/20 0.38
CA2 P00918 3/20 0.38
CDK4 P11802 2/20 0.38
CDK2 P24941 2/20 0.38
CDK7 P50613 2/20 0.38
CDK9 P50750 2/20 0.38
CCNT1 O60563 1/20 0.38
CCND1 P24385 1/20 0.38
CCNH P51946 1/20 0.38
CCNB1 P14635 1/20 0.37
CCNE1 P24864 1/20 0.37
ACVR1 Q04771 1/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
PTK2 Q05397 1/20 0.36
CA1 P00915 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
SCHEMBL4379764 0.88 SYK (0.55) FGFR4SYKFLT3CDK4CCND1
SCHEMBL1017621 0.88 SYK (0.55) FGFR4SYKFLT3CDK4CCND1
SCHEMBL1018605 0.80 FGFR4 (0.42) FGFR4SYKFLT3CA2CA1
SCHEMBL1021471 0.77 PTK2 (0.47) SYKJAK2JAK3PTK2BRD4
SCHEMBL4393127 0.73 L3MBTL1 (0.41) CDK1KDRCA2CDK4CDK2
SCHEMBL1015796 0.73 L3MBTL1 (0.41) CDK1KDRCA2CDK4CDK2
SCHEMBL14547910 0.73 KCNH3 (0.48) FGFR4SYKCDK1KDRCA2
SCHEMBL4723463 0.73 MAPT (0.41) FGFR4SYKCDK1KDRCA2
SCHEMBL4410271 0.73 FGFR4 (0.59) FGFR4JAK2JAK3PTK2
SCHEMBL4764792 0.72 CA1 (0.40) SYKFLT3CDK1KDRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271631-A2 INHIBITORS OF PROTEIN KINASES Portola Pharmaceuticals, Inc. (US) 2011-01-12 EP disclosed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 WO disclosed