SCHEMBL934426

SCHEMBL934426

CCCC(Cc1cccc(OC(F)(F)F)c1)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.49
TRPM8 Q7Z2W7 1/20 0.48
CETP P11597 3/20 0.46
AMPD2 Q01433 1/20 0.43
FOLH1 Q04609 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
PLA2G10 O15496 1/20 0.42
PLA2G2A P14555 1/20 0.42
PLA2G5 P39877 1/20 0.42
CNR1 P21554 1/20 0.42
GRIN2B Q13224 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL934355 0.84 EPHX1 (0.52) EPHX1GRIN2B
SCHEMBL934605 0.84 TAAR1 (0.55) FOLH1
SCHEMBL934550 0.82 EPHX1 (0.56) EPHX1TRPM8CETPAMPD2CHRM2
SCHEMBL23095166 0.81 CETP (0.48) CETPCHRM2CHRM1CHRM3
SCHEMBL26616861 0.81 EPHX1 (0.55) EPHX1TRPM8CETPAMPD2CHRM2
SCHEMBL13849933 0.80 CETP (0.58) CETPCHRM2CHRM1CHRM3
SCHEMBL13849901 0.80 CETP (0.58) CETPCHRM2CHRM1CHRM3
SCHEMBL14402392 0.80 CETP (0.58) CETPCHRM2CHRM1CHRM3
SCHEMBL22057166 0.78 CETP (0.47) CETPCHRM2CHRM1CHRM3
SCHEMBL22057298 0.77 CETP (0.46) CETPCHRM2CHRM1CHRM3

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-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 WO disclosed