SCHEMBL8895575

SCHEMBL8895575

O=C(O)CCc1ccc(C(Cc2ccccc2)NS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.56
ADAMTS5 Q9UNA0 1/20 0.56
MMP2 P08253 1/20 0.56
ALDH1A1 P00352 3/20 0.55
MAPT P10636 1/20 0.55
TBXA2R P21731 1/20 0.55
S1PR1 P21453 11/20 0.52
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 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
SCHEMBL8894761 0.94 ADAMTS5 (0.53) NPSR1ADAMTS5MMP2ALDH1A1MAPT
SCHEMBL8895536 0.93 ADAMTS5 (0.52) NPSR1ADAMTS5MMP2ALDH1A1MAPT
SCHEMBL8896354 0.91 NPSR1 (0.53) NPSR1ADAMTS5MMP2ALDH1A1TBXA2R
SCHEMBL8895463 0.90 ADAMTS5 (0.51) NPSR1ADAMTS5MMP2ALDH1A1S1PR1
SCHEMBL8896474 0.86 ADAMTS5 (0.49) ADAMTS5MMP2ALDH1A1S1PR1ATM
SCHEMBL8898502 0.86 IDO1 (0.49) NPSR1ADAMTS5MMP2ALDH1A1TBXA2R
SCHEMBL8895461 0.86 S1PR1 (0.49) NPSR1ADAMTS5MMP2ALDH1A1TBXA2R
SCHEMBL8898142 0.86 S1PR1 (0.49) NPSR1ADAMTS5MMP2ALDH1A1TBXA2R
SCHEMBL8895574 0.86 IDO1 (0.49) NPSR1ADAMTS5MMP2ALDH1A1TBXA2R
SCHEMBL8895361 0.86 UTS2R (0.53) NPSR1ALDH1A1MAPTTBXA2RS1PR1

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