SCHEMBL9095877

SCHEMBL9095877

COCOCC(=O)c1ncc(S(N)(=O)=O)s1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.36
ALDH1A1 P00352 1/20 0.32
CA4 P22748 1/20 0.31
CA1 P00915 3/20 0.30
FAAH O00519 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL9095614 0.73 CA2 (0.32) CA2CA4CA1CA12CA9
SCHEMBL19475597 0.72 CA2 (0.44) CA2ALDH1A1CA4CA1CA12
SCHEMBL1939405 0.70 CA2 (0.35) CA2CA1CA12CA9
SCHEMBL9094131 0.69 CA2 (0.39) CA2ALDH1A1CA1FAAHCA12
Hydrochloric Acid SCHEMBL9256738 0.69 CA2 (0.39) CA2CA1FAAHCA12CA9
SCHEMBL24979121 0.68 LOXL2 (0.39) CA2CA1CA12CA9
SCHEMBL9260724 0.68 LOXL2 (0.36) CA2
SCHEMBL21962509 0.67 CA2 (0.36) CA2CA4CA1CA12CA9
SCHEMBL5516839 0.65 CA2 (0.39) CA2CA1CA12CA9
SCHEMBL22509130 0.64 RAB9A (0.40) ALDH1A1

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
US-5519040-A Substituted thiazole sulfonamides as antiglaucoma agents ALLERGAN (US) 1996-05-21 US disclosed
WO-1995029904-A1 SUBSTITUTED THIAZOLE SULFONAMIDES AS ANTIGLAUCOMA AGENTS ALLERGAN (US) 1995-11-09 WO disclosed