SCHEMBL9850521

SCHEMBL9850521

O=C(COc1cccc(CCNS(=O)(=O)c2ccc(Cl)cc2)c1)N[C@@H](CO)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SGMS1 Q86VZ5 10/20 0.60
TBXA2R P21731 5/20 0.57
F2 P00734 2/20 0.56
PLG P00747 1/20 0.56
TBXAS1 P24557 1/20 0.48

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
SCHEMBL9850570 0.93 SGMS1 (0.60) SGMS1TBXA2RF2PLG
SCHEMBL9850586 0.91 SGMS1 (0.56) SGMS1TBXA2RF2PLGTBXAS1
SCHEMBL9850639 0.91 F2 (0.57) SGMS1TBXA2RF2PLGTBXAS1
SCHEMBL9850603 0.90 SGMS1 (0.59) SGMS1TBXA2RF2PLG
SCHEMBL9850329 0.90 SGMS1 (0.59) SGMS1TBXA2RF2PLG
SCHEMBL9850445 0.89 SGMS1 (0.54) SGMS1TBXA2RF2PLG
SCHEMBL9127503 0.86 TBXA2R (0.69) SGMS1TBXA2RF2PLGTBXAS1
SCHEMBL9130577 0.85 SGMS1 (0.64) SGMS1TBXA2RF2PLG
Hydrochloric Acid SCHEMBL9850342 0.85 SGMS1 (0.50) SGMS1TBXA2RF2PLGTBXAS1
SCHEMBL9127508 0.85 F2 (0.68) SGMS1TBXA2RF2PLGTBXAS1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0435085-A1 Phenoxyalkylcarboxylic amides, process for their preparation and drug containing them Roche Diagnostics GmbH (DE) 1991-07-03 EP disclosed