SCHEMBL18976723

SCHEMBL18976723

OCCNc1ccc(-c2nc3ccncc3n2-c2ccc(Cl)cc2F)cn1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 19/20 0.68
▸ KCNH2 Q12809 2/20 0.48

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
SCHEMBL20924435 0.90 KCNH2 (0.60) AOC3KCNH2
SCHEMBL18976721 0.90 AOC3 (0.66) AOC3KCNH2
SCHEMBL20924362 0.88 AOC3 (0.57) AOC3KCNH2
SCHEMBL20924324 0.88 AOC3 (0.54) AOC3KCNH2
SCHEMBL20924316 0.85 AOC3 (0.54) AOC3KCNH2
SCHEMBL20924446 0.85 AOC3 (0.59) AOC3KCNH2
SCHEMBL20924382 0.84 AOC3 (0.67) AOC3KCNH2
SCHEMBL18976720 0.83 AOC3 (0.52) AOC3KCNH2
SCHEMBL20924441 0.83 AOC3 (0.57) AOC3KCNH2
SCHEMBL16053598 0.81 AOC3 (1.00) AOC3KCNH2

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-2970260-B1 IMIDAZO[4,5-C]PYRIDINE AND PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS SSAO INHIBITORS PROXIMAGEN LLC (US) 2019-04-24 — — EP disclosed
WO-2017098236-A1 VAP-1 INHIBITORS FOR TREATING PAIN PROXIMAGEN LIMITED (GB) 2017-06-15 — — WO disclosed
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