SCHEMBL7922565

SCHEMBL7922565

FC(F)(F)c1cccc(C(CCCc2cccc(Oc3ccccc3)c2)C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 10/20 0.53
MAPK14 Q16539 1/20 0.42
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
ACP3 P15309 1/20 0.41
CETP P11597 1/20 0.41
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40

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
SCHEMBL7930475 0.90 FDFT1 (0.52) FDFT1CETP
SCHEMBL9804343 0.89 FDFT1 (0.58) FDFT1MAPK14CETP
SCHEMBL7922569 0.86 FDFT1 (0.40) FDFT1MAPK14PPARGPPARAACP3
SCHEMBL7922572 0.84 FDFT1 (0.41) FDFT1MAPK14IDO1TDO2
SCHEMBL9804456 0.83 FDFT1 (0.54) FDFT1CETP
SCHEMBL9804670 0.83 FDFT1 (0.56) FDFT1CETP
SCHEMBL9804487 0.83 CETP (0.49) FDFT1CETP
SCHEMBL7934874 0.82 FDFT1 (0.53) FDFT1PPARGPPARACETP
SCHEMBL7931643 0.82 FDFT1 (0.47) FDFT1CETP
SCHEMBL9804359 0.82 KDM4E (0.50) FDFT1CETP

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
US-RE37087-E1 1-(4-ETHOXYPHENYL)-4-(4-FLUORO-3-PHENOXYPHENYL)-1 -TRIFLUOROMETHYLBUTANE OR 1-(4-ETHOXY-3-FLUOROPHENYL)-4-(3-PHENOXYPHENYL)-1-TRIFLUOROMETHYLBUTANE, FOR EXAMPLE; COMBATS INSECTS AND MITES SCHERING AKTIENGESELLSCHAFT (DE) 2001-03-06 US claimed
US-4791123-A MITICIDES SCHERING AKT. (DE) 1988-12-13 US claimed