SCHEMBL9101455

SCHEMBL9101455

CCCCCC(F)C(=O)N(C)C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
GPR84 Q9NQS5 7/20 0.41
CA1 P00915 2/20 0.41
FFAR1 O14842 1/20 0.41
CES2 O00748 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
CA2 P00918 1/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL9099258 0.94 MAPT (0.50) MAPTCA1CES2ALDH1A1CA2
SCHEMBL25320247 0.77 MAPT (0.51) MAPTZDHHC20ZDHHC2FDPS
SCHEMBL1042434 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL8938931 0.77 CA1 (0.57) MAPTGPR84CA1FFAR1ALDH1A1
SCHEMBL8558195 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL24667473 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL8563312 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL23879493 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL8567310 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL9750430 0.77 CA2 (0.53) MAPTGPR84FFAR1LCKPPARD

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
EP-2460802-A1 TRIFLUOROMETHYLTHIOPHENIUM DERIVATIVE SALTS, PROCESS FOR PRODUCITON THEREOF, AND PROCESS FOR PRODUCTION OF TRIFLUOROMETHYL-CONTAINING COMPOUNDS USING SAME Nagoya Institute of Technology (JP) 2012-06-06 EP disclosed