SCHEMBL26071063

SCHEMBL26071063

Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COc1cccc(-c2nn[nH]c2N)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.52
PPARA Q07869 9/20 0.52
PPARG P37231 6/20 0.52
FFAR1 O14842 10/20 0.51
CHRM5 P08912 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL26070911 0.88 CYP2C9 (0.47) PPARDPPARAPPARGFFAR1
SCHEMBL26071018 0.83 NOTUM (0.38) PPARDFFAR1
SCHEMBL18006230 0.78 PPARD (0.51) PPARDPPARAPPARGFFAR1CHRM5
SCHEMBL18006416 0.77 PPARD (0.48) PPARDPPARAPPARGFFAR1
SCHEMBL26071027 0.76 SIRT2 (0.39)
SCHEMBL26071083 0.76 SLC22A12 (0.38)
SCHEMBL18006331 0.76 CYP2C9 (0.46) PPARDPPARAPPARGFFAR1
SCHEMBL26071040 0.76 SYK (0.37)
SCHEMBL18006214 0.76 PPARD (0.46) PPARDPPARAPPARGFFAR1
SCHEMBL5475700 0.75 PPARD (0.78) PPARDPPARAPPARGFFAR1CHRM5

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-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed