SCHEMBL7772178

SCHEMBL7772178

Fc1cc(Cl)cc(F)c1OC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.33
TSHR P16473 1/20 0.32
NOTUM Q6P988 1/20 0.32
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
GPR3 P46089 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL12736297 0.80 GPR3 (0.33) GPR3EPHX2
SCHEMBL22954099 0.78 CA1 (0.40) GRIN2BTSHRNOTUM
SCHEMBL10052628 0.76 ACHE (0.36) GRIN2BFFAR4GPR3EPHX2
SCHEMBL6558034 0.76 MAPT (0.36) NOTUMGPR3EPHX2
SCHEMBL19636607 0.76 ALDH1A1 (0.34) GPR3EPHX2
SCHEMBL3683516 0.76 GPR3 (0.31) GPR3EPHX2
SCHEMBL7723333 0.76 GPR3 (0.31) GPR3EPHX2
SCHEMBL760695 0.76 TAAR1 (0.37) FFAR1FFAR4GPR3EPHX2
SCHEMBL8467047 0.75 PDGFRB (0.37) TSHR
SCHEMBL9013332 0.74 MAPT (0.35) NOTUMGPR3EPHX2

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-2001098244-A1 METHOD FOR PRODUCING ARYL TRIFLUOROMETHYL ETHERS BAYER AKTIENGESELLSCHAFT (DE) 2001-12-27 WO disclosed