SCHEMBL8984877

SCHEMBL8984877

COc1ccc(CCC(=O)O)cc1-c1cc(CCC(=O)O)ccc1OC

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.57
FFAR4 Q5NUL3 4/20 0.56
TP53 P04637 3/20 0.53
MDM2 Q00987 3/20 0.53
RXRA P19793 1/20 0.52
PPARA Q07869 2/20 0.51
FFAR2 O15552 1/20 0.50
PPARD Q03181 1/20 0.50
ALOX5 P09917 1/20 0.50
OR51E2 Q9H255 1/20 0.50
GAA P10253 1/20 0.50
CYP19A1 P11511 1/20 0.49

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
SCHEMBL9679818 0.92 GABRA1 (0.57) FFAR1FFAR4TP53MDM2RXRA
SCHEMBL8984890 0.90 SELP (0.55) FFAR1FFAR4RXRAPPARAGAA
SCHEMBL7725124 0.89 FFAR1 (0.58) FFAR1FFAR4TP53MDM2RXRA
SCHEMBL347209 0.88 FFAR4 (0.61) FFAR1FFAR4ALOX5OR51E2
Hydrochloric Acid SCHEMBL3225386 0.86 FFAR4 (0.59) FFAR1FFAR4ALOX5OR51E2
SCHEMBL31337638 0.85 GAA (0.71) FFAR1FFAR4ALOX5OR51E2GAA
SCHEMBL2776108 0.85 FFAR4 (0.67) FFAR1FFAR4FFAR2
SCHEMBL490726 0.85 GAA (0.71) FFAR1FFAR4ALOX5OR51E2GAA
SCHEMBL9357796 0.84 GABRA1 (0.55) RXRAPPARAALOX5OR51E2GAA
SCHEMBL21222812 0.83 FFAR1 (0.55) FFAR1FFAR4PPARAALOX5OR51E2

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-0473308-B1 Aldose reductase inhibitor ASAHI CHEMICAL IND (JP) 1996-05-22 EP disclosed
US-5155259-A High stability; prevention and therapy of diabetic complications TOYO JOZO KABUSHIKI KAISHA (JP) 1992-10-13 US disclosed
EP-0473308-A1 Aldose reductase inhibitor ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1992-03-04 EP disclosed