SCHEMBL23329704

SCHEMBL23329704

C[C@@H](CN1CCOCC1)CS(=O)(=O)c1ccc(CC/C(=C/F)CN)cc1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AOC2 O75106 19/20 0.76
▸ MAOB P27338 1/20 0.49
▸ MAOA P21397 1/20 0.42

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
SCHEMBL23358498 0.86 AOC2 (1.00) AOC2MAOBMAOA
SCHEMBL23358519 0.86 AOC2 (1.00) AOC2MAOBMAOA
SCHEMBL23358500 0.86 AOC2 (1.00) AOC2MAOBMAOA
SCHEMBL11467924 0.76 AOC2 (0.60) AOC2
Hydrochloric Acid SCHEMBL11476141 0.75 AOC2 (0.59) AOC2
SCHEMBL23358465 0.74 AOC2 (1.00) AOC2MAOBMAOA
SCHEMBL23329661 0.70 AOC2 (1.00) AOC2MAOBMAOA
SCHEMBL23358639 0.70 AOC2 (1.00) AOC2MAOB
SCHEMBL23358640 0.70 AOC2 (1.00) AOC2MAOB
SCHEMBL23358638 0.70 AOC2 (1.00) AOC2MAOB

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
WO-2021083209-A1 SSAO INHIBITORS AND USE THEREOF ECCOGENE (SHANGHAI) CO., LTD. (CN) 2021-05-06 — — WO disclosed
Send feedback