SCHEMBL9510499

SCHEMBL9510499

CC(CNS(=O)(=O)c1ccccc1)c1ccc(OCC(=O)O)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.55
FFAR1 O14842 8/20 0.49
TBXA2R P21731 1/20 0.45
TBXAS1 P24557 1/20 0.45
PTGDR2 Q9Y5Y4 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ACLY P53396 1/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 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
SCHEMBL9512733 0.91 GRIA4 (0.53) GRIA4FFAR1L3MBTL1PKMKMT2A
SCHEMBL10708827 0.91 FFAR1 (0.49) GRIA4FFAR1PTGDR2L3MBTL1KMT2A
SCHEMBL9510778 0.90 PTGDR2 (0.51) GRIA4PTGDR2TDP1
SCHEMBL9510526 0.84 GRIA4 (0.60) GRIA4KMT2A
SCHEMBL27691417 0.83 GRIA4 (0.54) GRIA4PKMKMT2A
SCHEMBL9514108 0.82 FFAR1 (0.50) FFAR1PTGDR2L3MBTL1ACLY
SCHEMBL10702892 0.79 TBXA2R (0.52) GRIA4TBXA2RTBXAS1TDP1PKM
SCHEMBL10705664 0.79 TDP1 (0.55) PTGDR2TDP1
SCHEMBL9514097 0.78 FFAR1 (0.50) FFAR1TBXA2RTBXAS1
SCHEMBL9765316 0.77 ALDH1A1 (0.54) GRIA4TBXA2RTBXAS1

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 4 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