SCHEMBL6155035

SCHEMBL6155035

NC(=O)c1c(O)nc(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cccc(Br)c1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.64
▸ KCNH2 Q12809 3/20 0.55
▸ MAPK3 P27361 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ AURKB Q96GD4 2/20 0.55
▸ GP6 Q9HCN6 1/20 0.55

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
SCHEMBL6155026 1.00 SYK (0.64) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL6155667 0.89 SYK (0.70) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL6155657 0.89 SYK (0.70) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL13624629 0.85 SYK (0.73) SYK
SCHEMBL13624637 0.84 SYK (0.74) SYKKCNH2
SCHEMBL6155315 0.84 SYK (0.57) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL6155319 0.84 SYK (0.57) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL29794626 0.83 SYK (0.81) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL4712641 0.83 SYK (0.81) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL4712637 0.83 SYK (0.81) SYKKCNH2MAPK3MAPK1AURKB

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 5 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 claimed
EP-1184376-A1 NOVEL HETEROCYCLIC CARBOXAMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-03-06 — — EP claimed
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
Send feedback