SCHEMBL10339334

SCHEMBL10339334

O=C(O)C(CCCCCCOc1cccc(Cl)c1)Oc1ccc(Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.67
PPARA Q07869 13/20 0.67
HRH3 Q9Y5N1 3/20 0.49
KDM4E B2RXH2 1/20 0.49
FOLH1 Q04609 1/20 0.49
PPARD Q03181 2/20 0.48
FFAR1 O14842 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
SCHEMBL9858489 0.87 PPARG (0.76) PPARGPPARA
SCHEMBL9614120 0.82 PPARA (0.66) PPARGPPARA
SCHEMBL9614013 0.82 PPARA (0.66) PPARGPPARA
SCHEMBL9614051 0.81 PPARA (0.67) PPARGPPARA
SCHEMBL9696499 0.79 PPARG (0.64) PPARGPPARA
SCHEMBL9858575 0.78 PPARA (0.63) PPARGPPARA
SCHEMBL9696806 0.78 PPARA (0.63) PPARGPPARA
SCHEMBL6545280 0.78 PPARA (0.68) PPARGPPARA
SCHEMBL10420222 0.77 PPARA (0.80) PPARGPPARA
SCHEMBL9614177 0.77 PPARG (0.61) PPARGPPARAFOLH1PPARD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2193942-A None JP disclosed
JP-H02193942-A PHENOXYACETIC ACID DERIVATIVE NIPPON SHINYAKU CO LTD 1990-07-31 JP disclosed