SCHEMBL8896474

SCHEMBL8896474

COC(=O)CCCc1ccc(C(Cc2ccccc2)NS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 1/20 0.49
MMP2 P08253 1/20 0.49
S1PR1 P21453 11/20 0.48
ALDH1A1 P00352 2/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
AVPR1A P37288 1/20 0.44

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
SCHEMBL8896241 0.97 ADAMTS5 (0.48) ADAMTS5MMP2S1PR1ALDH1A1TP53
SCHEMBL8895471 0.96 NPSR1 (0.44) ADAMTS5MMP2S1PR1ALDH1A1
SCHEMBL8895463 0.94 ADAMTS5 (0.51) ADAMTS5MMP2S1PR1ALDH1A1ATM
SCHEMBL8895584 0.93 ALDH1A1 (0.46) MMP2ALDH1A1GAAATML3MBTL1
SCHEMBL8897043 0.92 ALDH1A1 (0.46) ADAMTS5MMP2ALDH1A1TP53GAA
SCHEMBL8895989 0.92 UTS2R (0.51) S1PR1ALDH1A1GAA
SCHEMBL8896351 0.92 ALDH1A1 (0.46) ADAMTS5MMP2S1PR1ALDH1A1TP53
SCHEMBL8896338 0.91 S1PR1 (0.49) ADAMTS5MMP2S1PR1ALDH1A1TP53
SCHEMBL8896968 0.91 S1PR1 (0.49) S1PR1ALDH1A1
SCHEMBL8895761 0.91 ALDH1A1 (0.49) MMP2ALDH1A1

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-5597848-A PLATELET AGGREGATION INHIBITORS, ANTITHROMBOTIC AGENTS, ANTIASTHMATIC AGENTS, ANTIALLERGIC AGENTS HOKURIKU SEIYAKU CO., LTD. (JP) 1997-01-28 US disclosed
EP-0663392-A1 BENZENESULFONAMIDE DERIVATIVE AND USE THEREOF HOKURIKU SEIYAKU CO., LTD. (JP) 1995-07-19 EP disclosed