SCHEMBL8896483

SCHEMBL8896483

O=C(O)CCCc1ccc(C(CCCCCCc2ccccc2)NS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 14/20 0.53
TBXA2R P21731 4/20 0.53
ALDH1A1 P00352 2/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.48
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.46
MMP2 P08253 1/20 0.46

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
SCHEMBL8896103 1.00 TBXAS1 (0.53) TBXAS1TBXA2RALDH1A1TP53GAA
SCHEMBL8897096 0.99 TBXAS1 (0.52) TBXAS1TBXA2RALDH1A1TP53GAA
SCHEMBL8895178 0.96 TBXAS1 (0.52) TBXAS1TBXA2RALDH1A1TP53GAA
SCHEMBL8895739 0.94 TBXAS1 (0.52) TBXAS1TBXA2RALDH1A1TP53GAA
SCHEMBL8419579 0.91 TBXAS1 (0.50) TBXAS1TBXA2R
SCHEMBL8894922 0.91 TBXAS1 (0.50) TBXAS1TBXA2RALDH1A1ATML3MBTL1
SCHEMBL8895059 0.91 TBXAS1 (0.50) TBXAS1TBXA2RALDH1A1ATML3MBTL1
SCHEMBL8894873 0.91 TBXAS1 (0.50) TBXAS1TBXA2RALDH1A1ATML3MBTL1
SCHEMBL8895793 0.91 TBXAS1 (0.50) TBXAS1TBXA2RALDH1A1ATML3MBTL1
SCHEMBL8896251 0.90 TBXAS1 (0.52) TBXAS1TBXA2RALDH1A1TP53GAA

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