SCHEMBL6158662

SCHEMBL6158662

Cc1cccc(Nc2nc(N[C@@H]3CCCC[C@@H]3NC(=O)OC(C)(C)C)nc(Oc3ccccc3Cl)c2C#N)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 12/20 0.46
▸ FER P16591 7/20 0.44
▸ MAPK3 P27361 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ GP6 Q9HCN6 1/20 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
SCHEMBL6158656 1.00 SYK (0.46) SYKFERMAPK3MAPK1KCNH2
SCHEMBL6155738 0.88 SYK (0.51) SYKFERMAPK3MAPK1KCNH2
SCHEMBL6155734 0.88 SYK (0.51) SYKFERMAPK3MAPK1KCNH2
SCHEMBL6155954 0.80 SYK (0.50) SYKFERAURKB
SCHEMBL6155956 0.80 SYK (0.50) SYKFERAURKB
SCHEMBL1988785 0.79 SYK (0.49) SYKFERMAPK3MAPK1KCNH2
SCHEMBL23397913 0.78 SYK (0.53) SYKFERMAPK3MAPK1KCNH2
SCHEMBL1986849 0.78 SYK (0.53) SYKFERMAPK3MAPK1KCNH2
SCHEMBL6155628 0.75 SYK (0.61) SYKFERMAPK3MAPK1KCNH2
SCHEMBL6155632 0.75 SYK (0.61) SYKFERMAPK3MAPK1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1184376-B1 NOVEL HETEROCYCLIC CARBOXAMIDE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-02-02 — — EP disclosed
US-6797706-B1 Heterocyclecarboxamide derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2004-09-28 — — US disclosed
EP-1184376-A1 NOVEL HETEROCYCLIC CARBOXAMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-03-06 — — EP disclosed
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