SCHEMBL3625635

SCHEMBL3625635

Cc1c(OCC(F)(F)C(F)C(F)(F)F)ncnc1-n1cncn1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.33
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30

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
SCHEMBL3624289 0.90 MAPK1 (0.36) GPR119CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL3624664 0.87 GPR119 (0.35) GPR119
SCHEMBL3626936 0.87 ACACB (0.30)
SCHEMBL3616440 0.87 ACACB (0.30)
SCHEMBL3660748 0.86 GPR119 (0.33) GPR119
SCHEMBL3626099 0.86
SCHEMBL3624312 0.86 ALDH1A1 (0.32)
SCHEMBL3625893 0.86
SCHEMBL3624556 0.86 MAPK1 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL3624296 0.86

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
WO-2010119878-A1 PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-21 WO claimed
WO-2010119878-A1 PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-21 WO disclosed