SCHEMBL31433006

SCHEMBL31433006

C=C(C)c1cc(CCC(=O)O)ccc1OC

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.55
FFAR1 O14842 9/20 0.50
FFAR4 Q5NUL3 5/20 0.50
PPARG P37231 1/20 0.47
FFAR2 O15552 1/20 0.46
PPARD Q03181 1/20 0.46
ALOX5 P09917 1/20 0.44
OR51E2 Q9H255 1/20 0.44
GAA P10253 1/20 0.44
PLA2G4A P47712 1/20 0.44
CYP19A1 P11511 1/20 0.44

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
SCHEMBL23935649 0.88 PPARA (0.57) PPARAFFAR1FFAR4PPARGFFAR2
SCHEMBL31432825 0.87 ALOX5 (0.47) PPARAALOX5OR51E2CYP19A1
SCHEMBL24593698 0.84 PPARA (0.59) PPARAFFAR1FFAR4PPARGFFAR2
SCHEMBL30854479 0.81 PPARA (0.67) PPARAFFAR1FFAR4PPARGFFAR2
SCHEMBL347209 0.81 FFAR4 (0.61) FFAR1FFAR4ALOX5OR51E2PLA2G4A
SCHEMBL20746782 0.80 LCK (0.50) FFAR1
Hydrochloric Acid SCHEMBL3225386 0.80 FFAR4 (0.59) FFAR1FFAR4ALOX5OR51E2PLA2G4A
SCHEMBL8984877 0.80 FFAR1 (0.57) PPARAFFAR1FFAR4FFAR2PPARD
SCHEMBL3688566 0.79 PPARA (0.52) PPARAFFAR1FFAR4FFAR2ALOX5
SCHEMBL23935757 0.79 ALOX5 (0.54) PPARAFFAR1FFAR4PPARGALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025052333-A1 NOVEL 1,2,4-OXADIAZOLES COMPOUNDS AS FUNGICIDE PI INDUSTRIES LTD. (IN) 2025-03-13 WO disclosed