SCHEMBL7929110

SCHEMBL7929110

Fc1ccc(CCCC(c2ccc(Br)cc2)C(F)(F)F)cc1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 7/20 0.37
LPAR1 Q92633 6/20 0.34
LPAR5 Q9H1C0 6/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL9493734 0.89 CETP (0.40) FDFT1LPAR1LPAR5
SCHEMBL407786 0.87 LTA4H (0.41) FDFT1
SCHEMBL7934903 0.84 TTR (0.41) FDFT1
SCHEMBL7931643 0.84 FDFT1 (0.47) FDFT1
SCHEMBL9561225 0.83 PPARA (0.37)
SCHEMBL7922569 0.83 FDFT1 (0.40) FDFT1
SCHEMBL9570834 0.83 TACR1 (0.34) LPAR1LPAR5POLB
SCHEMBL7932383 0.83 FDFT1 (0.37) FDFT1
SCHEMBL9628951 0.82 MAOA (0.39)
SCHEMBL9629106 0.81 FDFT1 (0.35) FDFT1LPAR1LPAR5

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
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 disclosed