SCHEMBL7720150

SCHEMBL7720150

CCCCCCC(F)(F)C(F)(F)CC(F)(F)[C](F)F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.46
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 0.41
FAAH O00519 7/20 0.35
GGPS1 O95749 6/20 0.35
CES1 P23141 5/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
FDPS P14324 8/20 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
SCHEMBL13717050 0.81 CES2 (0.59) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL4077269 0.81 CES2 (0.59) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL959689 0.78 CES2 (0.56) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL5715654 0.77 CES2 (0.45) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL11861544 0.77 CES2 (0.45) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL17830599 0.74 LMNA (0.62) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL17830629 0.74 LMNA (0.48) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL17830626 0.74 CES2 (0.47) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL1262707 0.72 CES2 (0.37) CES2LPAR1LPAR3FAAHGGPS1
SCHEMBL23825107 0.72 CES2 (0.48) CES2LPAR1LPAR3FAAHGGPS1

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-6376634-B1 ORGANOSILICON POLYMERS JSR CORPORATION (JP) 2002-04-23 US disclosed