SCHEMBL8802863

SCHEMBL8802863

O=C(O)COc1cccc(CCCC(=O)NC(Cc2ccccc2)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 2/20 0.53
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
PTGDR2 Q9Y5Y4 7/20 0.53
ALDH1A1 P00352 2/20 0.49
HTT P42858 1/20 0.49
NCOA1 Q15788 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
KMT2A Q03164 1/20 0.44
POLB P06746 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
SCHEMBL8804559 0.93 ALDH1A1 (0.51) PTGIRPPARAPPARGPTGDR2ALDH1A1
SCHEMBL8356625 0.88 PTGIR (0.56) PTGIRPPARAPPARGPTGDR2ALDH1A1
SCHEMBL8356926 0.88 ALDH1A1 (0.54) PTGIRPPARAPPARGPTGDR2ALDH1A1
SCHEMBL8804289 0.82 PTGDR2 (0.57) PTGIRPPARAPPARGPTGDR2
SCHEMBL8356604 0.81 PTGIR (0.60) PTGIRPPARAPPARGPTGDR2KMT2A
SCHEMBL8351416 0.81 PTGIR (0.53) PTGIRPPARAPPARGPTGDR2KMT2A
SCHEMBL8803298 0.80 PTGDR2 (0.60) PTGIRPPARAPPARGPTGDR2
SCHEMBL9716964 0.80 CNR1 (0.53) PPARAPPARGSMN1; SMN2
SCHEMBL8358846 0.79 PPARA (0.60) PPARAPPARGALDH1A1HTTKMT2A
SCHEMBL8354917 0.78 ALDH1A1 (0.51) ALDH1A1HTTNCOA1SMN1; SMN2NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0558062-B1 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO (JP) 1997-05-07 EP claimed
EP-0558062-A2 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-01 EP claimed
EP-0558062-B1 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO (JP) 1997-05-07 EP disclosed
US-5536736-A CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 1996-07-16 US disclosed
US-5378716-A Prostaglandin agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-01-03 US disclosed
EP-0558062-A2 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-01 EP disclosed