SCHEMBL9468677

SCHEMBL9468677

NC/C(=C\F)COc1ccc2ccccc2c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AOC2 O75106 4/20 0.69
▸ MAOA P21397 4/20 0.69
▸ MAOB P27338 4/20 0.69
▸ DAO P14920 2/20 0.69
▸ AOC3 Q16853 13/20 0.57
▸ AGXT P21549 2/20 0.54
▸ PTPN7 P35236 1/20 0.53

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
SCHEMBL9468678 1.00 AOC2 (0.69) AOC2MAOAMAOBDAOAOC3
SCHEMBL9468836 0.84 AGXT (0.54) AOC2MAOAMAOBDAOAGXT
SCHEMBL9468350 0.84 AGXT (0.54) AOC2MAOAMAOBDAOAGXT
Hydrochloric Acid SCHEMBL30228551 0.84 AOC3 (0.57) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL30228499 0.84 AOC3 (0.57) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL28992122 0.84 AOC3 (0.57) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL28992077 0.84 AOC3 (0.57) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL30228552 0.82 AOC3 (0.59) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL28992083 0.82 AOC3 (0.59) AOC2MAOAMAOBDAOAOC3
Hydrochloric Acid SCHEMBL30228808 0.82 AOC3 (0.59) AOC2MAOAMAOBDAOAOC3

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-5252608-A Preventing the abnormal deposition of collagen by administering a halogenated allyl amines MERRELL DOW PHARMACEUTICALS INC. (US) 1993-10-12 — — US claimed
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