SCHEMBL16348540

SCHEMBL16348540

O=c1[nH]c2ncccc2n1-c1cc(F)cc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.53
▸ PRKCQ Q04759 13/20 0.47
▸ PRKCA P17252 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GRIN1 Q05586 2/20 0.41
▸ GRIN2B Q13224 2/20 0.41
▸ FEN1 P39748 1/20 0.40
▸ CALCRL Q16602 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
SCHEMBL30615357 0.89 PRKCQ (0.51) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL11511885 0.81 DAO (0.58) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL30257859 0.79 DAO (0.55) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL30377628 0.77 DAO (0.50) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL30615567 0.77 DAO (0.47) DAOPRKCQPRKCAADORA3GRIN1
SCHEMBL30615537 0.77 PRKCQ (0.48) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL21464054 0.77 PRKCQ (0.48) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL30615338 0.77 PRKCQ (0.48) DAOPRKCQPRKCAALDH1A1GRIN1
SCHEMBL30794441 0.77 DAO (0.53) DAOPRKCQPRKCAADORA3ALDH1A1
SCHEMBL21463768 0.76 PRKCQ (0.50) DAOPRKCQPRKCAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220735-B2 Benzimidazolone histamine H3 antagonists SCHERING CORPORATION (US) 2007-05-22 — — US disclosed
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