SCHEMBL9510823

SCHEMBL9510823

O=C(O)CNC(=O)C(F)Oc1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 4/20 0.58
SGMS1 Q86VZ5 2/20 0.54
TBXAS1 P24557 2/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PPARG P37231 2/20 0.47
PRMT1 Q99873 2/20 0.47
AKR1C3 P42330 1/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 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
SCHEMBL9510559 0.88 TBXA2R (0.53) TBXA2RSGMS1TBXAS1ALDH1A1MAPT
SCHEMBL9510832 0.84 TBXA2R (0.54) TBXA2RSGMS1MEN1KMT2APPARG
SCHEMBL8840163 0.79 TBXA2R (0.79) TBXA2RSGMS1TBXAS1MEN1KMT2A
SCHEMBL11339500 0.78 TBXA2R (0.58) TBXA2RSGMS1TBXAS1MEN1KMT2A
SCHEMBL9131948 0.78 TBXA2R (0.76) TBXA2RSGMS1TBXAS1MEN1KMT2A
SCHEMBL11338344 0.76 PPARA (0.61) TBXA2RSGMS1TBXAS1MEN1KMT2A
SCHEMBL9127483 0.76 TBXA2R (0.72) TBXA2RSGMS1TBXAS1MEN1KMT2A
Daltroban SCHEMBL309160 0.75 TBXA2R (1.00) TBXA2RSGMS1TBXAS1MEN1KMT2A
SCHEMBL9130164 0.75 TBXA2R (0.81) TBXA2RTBXAS1MEN1KMT2APRMT1
SCHEMBL9493082 0.74 MEN1 (0.64) TBXA2RSGMS1MEN1KMT2APPARG

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
EP-0325245-B1 Phenoxyacetic acid derivatives, preparation thereof, pharmaceutical compositions comprising them and use TANABE SEIYAKU CO (JP) 1993-10-20 EP disclosed
US-4948810-A PLATELET AGGREGATION INHIBITORS TANABE SEIYAKU CO., LTD. (JP) 1990-08-14 US disclosed