SCHEMBL25839760

SCHEMBL25839760

CC(C)(C)NC(=O)c1noc(-c2ccc(OC/C(=C/I)CN)cc2)n1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 20/20 0.84
MAOB P27338 1/20 0.51

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
SCHEMBL25839757 0.92 AOC3 (0.84) AOC3MAOB
SCHEMBL21889027 0.91 AOC3 (1.00) AOC3MAOB
SCHEMBL21889026 0.79 AOC3 (0.74) AOC3MAOB
SCHEMBL21888998 0.71 AOC3 (1.00) AOC3
SCHEMBL21889033 0.70 AOC3 (1.00) AOC3
SCHEMBL21889028 0.69 AOC3 (1.00) AOC3
SCHEMBL16766765 0.68 AOC3 (0.77) AOC3MAOB
SCHEMBL16767511 0.68 AOC3 (0.77) AOC3MAOB
SCHEMBL16766763 0.68 AOC3 (0.77) AOC3MAOB
SCHEMBL16766991 0.68 AOC3 (1.00) AOC3MAOB

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-3626699-B1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2023-07-12 EP disclosed