SCHEMBL8965375

SCHEMBL8965375

O=C(O)COc1cccc(CCCCn2cc(C(c3ccccc3)c3ccccc3)cn2)c1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 13/20 0.63
PTGIR P43119 5/20 0.55
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
PTGDR Q13258 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
SCHEMBL8804127 0.97 PTGDR2 (0.67) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965139 0.93 PTGDR2 (0.61) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965905 0.89 PTGIR (0.52) PTGDR2PTGIRPPARA
SCHEMBL8965728 0.88 PTGDR2 (0.57) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8358402 0.87 PTGDR2 (0.55) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965035 0.86 PTGDR2 (0.55) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8358618 0.86 PTGIR (0.56) PTGDR2PTGIRPPARAPPARG
SCHEMBL8965896 0.85 PTGIR (0.53) PTGDR2PTGIRPPARA
SCHEMBL8965703 0.84 PTGDR2 (0.65) PTGDR2PTGIRPTGDR
SCHEMBL3180595 0.81 PTGDR2 (0.94) PTGDR2PTGIRPPARAPPARGPTGDR

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
US-5378716-A Prostaglandin agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-01-03 US claimed
EP-0558062-A2 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-01 EP claimed
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