SCHEMBL6155319

SCHEMBL6155319

CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1Nc1nc(O)c(C(N)=O)c(Nc2cccc(Br)c2)n1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.57
▸ MAPK3 P27361 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ KCNH2 Q12809 2/20 0.42
▸ AURKB Q96GD4 2/20 0.42
▸ GP6 Q9HCN6 1/20 0.42
▸ ZAP70 P43403 1/20 0.40

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
SCHEMBL6155315 1.00 SYK (0.57) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL6155026 0.84 SYK (0.64) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL6155035 0.84 SYK (0.64) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL6155954 0.80 SYK (0.50) SYKAURKB
SCHEMBL6155956 0.80 SYK (0.50) SYKAURKB
SCHEMBL23397913 0.76 SYK (0.53) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL1986849 0.76 SYK (0.53) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL6155667 0.75 SYK (0.70) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL6155657 0.75 SYK (0.70) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL15631805 0.75 SYK (0.77) SYKMAPK3MAPK1KCNH2AURKB

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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