SCHEMBL8965283

SCHEMBL8965283

O=C(O)COc1cccc(CCCc2cnc(C(c3ccccc3)c3ccccc3)[nH]2)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 11/20 0.57
PTGIR P43119 2/20 0.53
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
PTGDR Q13258 1/20 0.46
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40

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
SCHEMBL2769715 0.79 PPARA (0.74) PTGDR2PTGIRPPARAPPARGALOX15
SCHEMBL8356621 0.78 GPR84 (0.44)
SCHEMBL8965343 0.77 PTGDR2 (0.56) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL4271985 0.77 PTGDR2 (0.56) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8804127 0.77 PTGDR2 (0.67) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965420 0.77 PTGDR2 (0.61) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965929 0.77 PTGDR2 (0.61) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL2770489 0.77 PPARA (0.62) PTGDR2PTGIRPPARAPPARGLMNA
SCHEMBL8964950 0.76 PTGDR2 (0.68) PTGDR2PTGIRPPARAPPARGPTGDR
SCHEMBL8965375 0.76 PTGDR2 (0.63) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0558062-A2 Phenoxyacetic acid derivatives and pharmaceutical compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-01 EP disclosed