SCHEMBL9740473

SCHEMBL9740473

CCCc1cc(Cl)c(OC(C(=O)OC)c2ccccc2)c(C(C)=O)c1O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.56
PPARG P37231 16/20 0.56
GCGR P47871 1/20 0.40
PRKCI P41743 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
SCHEMBL9739383 0.91 PPARA (0.61) PPARAPPARG
SCHEMBL4013883 0.73 PPARA (0.82) PPARAPPARG
SCHEMBL4012619 0.72 PPARA (0.84) PPARAPPARG
SCHEMBL13924214 0.72 PPARA (0.84) PPARAPPARG
SCHEMBL9126457 0.72 PPARA (0.54) PPARAPPARGGCGR
SCHEMBL4011903 0.71 PPARG (0.51) PPARAPPARG
SCHEMBL9128765 0.71 PPARA (0.53) PPARAPPARGGCGR
SCHEMBL9739158 0.71 PRKCI (0.42) PPARAPPARGPRKCI
SCHEMBL9739521 0.70 PRKCI (0.56) PRKCI
SCHEMBL9307429 0.70 PPARA (0.53) PPARAPPARG

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
US-5087638-A Inhibitors of mammalian leukotriene biosynthesis MERCK FROSST CANADA, INC. (CA) 1992-02-11 US disclosed
EP-0338782-A1 Benzofuran derivatives MERCK FROSST CANADA INC. (CA) 1989-10-25 EP disclosed
US-4863958-A TREATING ALLERGIC CONDITIONS, ASTHMA, CARDIOVASCULAR DISORDERS, AND INFLAMMATION MERCK FROSST CANADA, INC. (CA) 1989-09-05 US disclosed