SCHEMBL1072153

SCHEMBL1072153

OC1CCN(c2ccc(Nc3ncc4cc[nH]c4n3)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.55
LRRK2 Q5S007 3/20 0.53
DCLK1 O15075 1/20 0.53
CDK4 P11802 3/20 0.52
CCND1 P24385 3/20 0.52
CDK2 P24941 3/20 0.52
FGFR1 P11362 1/20 0.52
CCNA2 P20248 1/20 0.52
FGFR2 P21802 1/20 0.52
FGFR4 P22455 1/20 0.52
FGFR3 P22607 1/20 0.52
TNK2 Q07912 1/20 0.51
STAT6 P42226 1/20 0.50
JAK2 O60674 1/20 0.49
JAK3 P52333 1/20 0.49
WEE1 P30291 1/20 0.48
CDK1 P06493 2/20 0.47
CCNB1 P14635 2/20 0.47
CCNE1 P24864 2/20 0.47
MAPK8 P45983 1/20 0.47

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
SCHEMBL29277198 0.85 SYK (0.60) SYKCDK4CCND1CDK2CCNA2
SCHEMBL29813554 0.84 EGFR (0.62) CDK4CCND1CDK2FGFR1CCNA2
SCHEMBL3976815 0.76 MAPK8 (0.61) SYKLRRK2DCLK1CDK4CCND1
SCHEMBL12639329 0.75 CDK4 (0.61) SYKCDK4CCND1CDK2FGFR1
SCHEMBL26806030 0.75 SYK (0.50) SYKLRRK2DCLK1CDK4CCND1
SCHEMBL1019228 0.74 JAK3 (0.66) SYKJAK2JAK3MAPK8PTK2
SCHEMBL3973205 0.74 CDK4 (0.73) CDK4CCND1CDK2FGFR1CCNA2
SCHEMBL29576338 0.74 STAT6 (0.56) SYKLRRK2DCLK1CDK4CCND1
SCHEMBL16581017 0.74 WEE1 (0.53) SYKCDK4CCND1CDK2FGFR1
SCHEMBL3967392 0.74 CDK4 (0.60) SYKLRRK2DCLK1CDK4CCND1

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 claimed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 WO claimed