SCHEMBL8965754

SCHEMBL8965754

Cc1cc(/C=C/Cn2cc(C(c3ccccc3)c3ccccc3)cn2)cc(OCC(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.44
PTGIR P43119 4/20 0.44
PPARA Q07869 3/20 0.41
PTGDR2 Q9Y5Y4 5/20 0.39
HDAC3 O15379 3/20 0.36
HDAC1 Q13547 3/20 0.36
FFAR1 O14842 1/20 0.35
PPARD Q03181 1/20 0.35
HDAC2 Q92769 2/20 0.35
NCOR2 Q9Y618 2/20 0.35
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
PTPN7 P35236 1/20 0.34
PTGDR Q13258 1/20 0.34

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
SCHEMBL8358853 1.00 PPARG (0.44) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965096 0.87 PPARG (0.50) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965101 0.87 PPARG (0.50) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8355223 0.83 PTGIR (0.46) PPARGPTGIRPPARAPTGDR2PTPN7
SCHEMBL8965715 0.83 PTGIR (0.48) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965712 0.83 PTGIR (0.48) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965328 0.83 PTGIR (0.46) PPARGPTGIRPPARAPTGDR2PTPN7
SCHEMBL9262923 0.81 PPARG (0.46) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965136 0.81 PPARG (0.46) PPARGPTGIRPPARAPTGDR2HDAC3
SCHEMBL8965323 0.78 PTGIR (0.52) PTGIRPTGDR2MEN1KMT2AALDH1A1

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