SCHEMBL9014493

SCHEMBL9014493

O=C(O)COc1cccc2c1CCC/C2=C/CONC(Cc1cc[nH]c1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 17/20 0.39
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PTGDR Q13258 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.32

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
SCHEMBL9014499 1.00 PTGIR (0.39) PTGIRPPARGPPARDPTGDRMRGPRX4
SCHEMBL9014215 0.85 TBXAS1 (0.39) PTGIR
SCHEMBL9014217 0.85 TBXAS1 (0.39) PTGIR
SCHEMBL9014438 0.84 TBXAS1 (0.41) PTGIRPPARGPPARD
SCHEMBL9014441 0.84 TBXAS1 (0.41) PTGIRPPARGPPARD
SCHEMBL9014512 0.80 PTGIR (0.40) PTGIRPTGDR
SCHEMBL9014522 0.80 PTGIR (0.40) PTGIRPTGDR
SCHEMBL9014633 0.80 PTGIR (0.45) PTGIR
SCHEMBL9014629 0.80 PTGIR (0.45) PTGIR
SCHEMBL9014200 0.79 PTGIR (0.55) PTGIRPTGDR

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-0581187-B1 Oxime derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP disclosed
US-5480998-A Oxime derivative ONO PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 US disclosed
EP-0581187-A1 Oxime derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-02-02 EP disclosed