SCHEMBL23655259

SCHEMBL23655259

CCC(=O)CCc1ccc(OC)c(C)c1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
IAPP P10997 2/20 0.38
FFAR4 Q5NUL3 3/20 0.36
FFAR1 O14842 1/20 0.36
FFAR2 O15552 1/20 0.36
TAAR1 Q96RJ0 1/20 0.34
PPARA Q07869 3/20 0.34
PPARD Q03181 2/20 0.34
PPARG P37231 1/20 0.33
ALOX5 P09917 1/20 0.33
OR51E2 Q9H255 1/20 0.33

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
SCHEMBL16048607 0.85 CYP4F2 (0.46) ALDH1A1HPGDHSD17B10FFAR4
SCHEMBL28358420 0.80 PPARA (0.44) ALDH1A1HPGDHSD17B10FFAR4FFAR1
SCHEMBL28453244 0.78 PPARA (0.44) IAPPTAAR1PPARAALOX5OR51E2
SCHEMBL28358438 0.75 GPR52 (0.39) ALDH1A1HPGDHSD17B10FFAR4FFAR1
SCHEMBL28389058 0.73 IAPP (0.43) ALDH1A1IAPPALOX5OR51E2
SCHEMBL16048571 0.71 CYP4F2 (0.45) ALDH1A1HPGDFFAR4
SCHEMBL28801709 0.71 ALOX5 (0.40) ALDH1A1IAPPTAAR1ALOX5OR51E2
SCHEMBL13545173 0.70 MTNR1A (0.55) IAPPTAAR1
SCHEMBL28612635 0.69 IAPP (0.49) IAPPALOX5OR51E2
SCHEMBL16048995 0.69 CYP4F2 (0.48) ALDH1A1HPGDHSD17B10

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
EP-3409671-B1 ISOTHIAZOLE DERIVATIVES AS GPR120 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2021-07-21 EP disclosed