SCHEMBL9510778

SCHEMBL9510778

CC(CNS(=O)(=O)c1ccc(Cl)cc1)c1ccc(OCC(=O)O)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.51
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GRIA4 P48058 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
SCHEMBL10708827 0.90 FFAR1 (0.49) PTGDR2TSHRGRIA4
SCHEMBL9510499 0.90 GRIA4 (0.55) PTGDR2TDP1GRIA4
SCHEMBL10705664 0.89 TDP1 (0.55) PTGDR2CA1CA2TSHRTDP1
SCHEMBL9510767 0.83 ALDH1A1 (0.54) CA1CA2TSHR
SCHEMBL9512733 0.82 GRIA4 (0.53) TSHRGRIA4
SCHEMBL9510541 0.80 TBXA2R (0.59)
SCHEMBL9514151 0.79 PTGDR2 (0.49) PTGDR2TSHRTDP1
SCHEMBL7911832 0.78 ALDH1A1 (0.60) PTGDR2TSHR
SCHEMBL9765316 0.77 ALDH1A1 (0.54) CA1CA2TSHRGRIA4
SCHEMBL27691417 0.76 GRIA4 (0.54) CA1CA2GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255728-A2 Phenoxyacetic acid compounds, their preparation, pharmaceutical composition and use TANABE SEIYAKU CO., LTD. (JP) 1988-02-10 EP claimed
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
US-4866196-A ANTICOAGULANTS TANABE SEIYAKU CO., LTD. (JP) 1989-09-12 US disclosed
EP-0325245-A1 Phenoxyacetic acid derivatives, preparation thereof, pharmaceutical compositions comprising them and use TANABE SEIYAKU CO., LTD. (JP) 1989-07-26 EP disclosed