Sugi Predict

Sugi Predict / Compounds / SCHEMBL27765663

SCHEMBL27765663

SCHEMBL27765663

CC(=O)OCC1Cc2ccc(S(=O)(=O)Cl)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 11/20 0.43
▸ CA2 P00918 11/20 0.43
▸ CA12 O43570 9/20 0.43
▸ CA7 P43166 9/20 0.43
▸ CA14 Q9ULX7 9/20 0.43
▸ CA9 Q16790 6/20 0.42
▸ TBXA2R P21731 8/20 0.39
▸ PNMT P11086 1/20 0.36

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
SCHEMBL14508405 0.79 CA1 (0.41) CA1CA2CA12CA7CA14
SCHEMBL1472801 0.78 CA1 (0.43) CA1CA2CA12CA7CA14
SCHEMBL28294086 0.78 CA1 (0.39) CA1CA2CA12CA7CA14
SCHEMBL5472752 0.77 CA1 (0.43) CA1CA2CA12CA7CA14
SCHEMBL7685050 0.76 ALDH1A1 (0.44) —
SCHEMBL2250545 0.74 CYP1A2 (0.46) —
SCHEMBL4914678 0.73 CA1 (0.46) CA1CA2CA12CA7CA14
SCHEMBL29519118 0.73 CA1 (0.46) CA1CA2CA12CA7CA14
SCHEMBL1971027 0.73 CA1 (0.76) CA1CA2CA12CA7CA14
SCHEMBL12365884 0.71 ALDH1A1 (0.38) —

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
CN-101421258-B Sulfonyl-substituted bicyclic compounds as PPAR modulators KALYPSYS INC 2013-08-21 — — CN disclosed
CN-101421258-A Sulfonyl-substituted bicyclic compounds as PPAR modulators KALYSPSYS INC (US) 2009-04-29 — — CN disclosed