SCHEMBL20924441

SCHEMBL20924441

Cc1nc(NCCO)ncc1-c1nc2ccncc2n1-c1ccc(Cl)cc1F

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 16/20 0.57
▸ KCNH2 Q12809 2/20 0.42
▸ ADORA1 P30542 1/20 0.39
▸ CYP1A2 P05177 1/20 0.37
▸ TGFBR1 P36897 1/20 0.37

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
SCHEMBL18976721 0.89 AOC3 (0.66) AOC3KCNH2
SCHEMBL20924316 0.86 AOC3 (0.54) AOC3KCNH2CYP1A2TGFBR1
SCHEMBL18976723 0.83 AOC3 (0.68) AOC3KCNH2
SCHEMBL20924562 0.82 AOC3 (0.62) AOC3KCNH2
SCHEMBL20924385 0.80 AOC3 (0.62) AOC3KCNH2
SCHEMBL16053459 0.78 AOC3 (0.82) AOC3KCNH2
SCHEMBL18976977 0.77 AOC3 (0.54) AOC3KCNH2
SCHEMBL20924389 0.77 AOC3 (0.63) AOC3KCNH2
SCHEMBL20924311 0.76 AOC3 (0.59) AOC3KCNH2
SCHEMBL20924442 0.75 AOC3 (0.60) 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 1 patent. 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
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