SCHEMBL14977694

SCHEMBL14977694

CCC(Nc1ncc(C(N)=O)c(Nc2cccc(C)c2)n1)N(C(=O)O)C1CC1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.62
▸ KCNH2 Q12809 7/20 0.57
▸ AURKB Q96GD4 5/20 0.57
▸ ZAP70 P43403 1/20 0.57
▸ MAPK3 P27361 4/20 0.56
▸ MAPK1 P28482 4/20 0.56
▸ GP6 Q9HCN6 1/20 0.56

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
SCHEMBL14977487 0.89 SYK (0.67) SYK
SCHEMBL14977864 0.88 SYK (0.56) SYKKCNH2AURKBZAP70MAPK3
SCHEMBL2714184 0.85 FER (0.47) SYKKCNH2AURKBZAP70
SCHEMBL2627400 0.79 SYK (0.83) SYKKCNH2AURKBZAP70
SCHEMBL14977695 0.78 SYK (0.67) SYKKCNH2AURKBZAP70MAPK3
SCHEMBL16194584 0.78 SYK (0.67) SYKKCNH2AURKBZAP70
SCHEMBL16194903 0.78 SYK (0.67) SYKKCNH2AURKBZAP70
SCHEMBL14981581 0.78 SYK (0.67) SYKKCNH2AURKBZAP70
SCHEMBL16194871 0.78 SYK (0.64) SYKKCNH2AURKBZAP70
SCHEMBL1353493 0.77 SYK (1.00) SYKKCNH2AURKBZAP70

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-2782580-A1 SELECTIVE KINASE INHIBITORS Portola Pharmaceuticals, Inc. (US) 2014-10-01 — — EP disclosed
WO-2013078468-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — WO disclosed
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