SCHEMBL9854191

SCHEMBL9854191

CCCCCCCCCCCCCC(CCCCCCCCCC(F)(F)F)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.46
CA2 P00918 1/20 0.46
MAPT P10636 1/20 0.43
LPAR1 Q92633 1/20 0.42
LPAR3 Q9UBY5 1/20 0.42
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
FAAH O00519 7/20 0.40
CES1 P23141 5/20 0.40
GPR84 Q9NQS5 3/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
FFAR1 O14842 1/20 0.40
MMP2 P08253 3/20 0.39
MMP3 P08254 3/20 0.39
MMP1 P03956 2/20 0.39
MMP7 P09237 1/20 0.39

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
SCHEMBL9332419 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL9639022 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL8950093 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL1260244 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL1260468 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL1259905 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL1038699 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL9727189 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL11380532 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH
SCHEMBL9356367 0.84 CA2 (0.59) CA2MAPTGRIK1GRIK2FAAH

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
EP-0282391-B1 PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL COMPOUNDS RHONE-POULENC CHIMIE (FR) 1991-08-21 EP disclosed
EP-0282391-A1 Process for the preparation of trifluoromethyl compounds RHONE-POULENC CHIMIE (FR) 1988-09-14 EP disclosed