SCHEMBL9514151

SCHEMBL9514151

CC(Cc1ccc(OCC(=O)O)c(F)c1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.49
FFAR1 O14842 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NR3C1 P04150 1/20 0.42

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
SCHEMBL10711216 0.91 FFAR1 (0.47) PTGDR2FFAR1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL9514097 0.91 FFAR1 (0.50) FFAR1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL10704116 0.88 PTGDR2 (0.48) PTGDR2FFAR1
SCHEMBL9510498 0.83 ADRB2 (0.52) ALDH1A1NPSR1
SCHEMBL9510541 0.80 TBXA2R (0.59) ALDH1A1
SCHEMBL9510778 0.79 PTGDR2 (0.51) PTGDR2TSHRTDP1
SCHEMBL9765285 0.79 KDM4E (0.53) PTGDR2ALDH1A1LMNASMN1; SMN2NPSR1
SCHEMBL9765309 0.78 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TSHR
SCHEMBL27672375 0.77 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2NPSR1TSHR
SCHEMBL9510759 0.74 POLB (0.47) ALDH1A1LMNASMN1; SMN2NPSR1NR3C1

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 3 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