SCHEMBL8743995

SCHEMBL8743995

O=C(F)CCCC(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.31
OXER1 Q8TDS5 1/20 0.31
CES1 P23141 5/20 0.30
CES2 O00748 2/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL8744170 0.92 FAAH (0.34) FAAHOXER1CES1CES2MEN1
SCHEMBL20543468 0.90 FAAH (0.37) FAAHOXER1CES1CES2MEN1
SCHEMBL28403565 0.90 FAAH (0.37) FAAHOXER1CES1CES2MEN1
SCHEMBL28405229 0.90 FAAH (0.37) FAAHOXER1CES1CES2MEN1
SCHEMBL20543472 0.90 FAAH (0.37) FAAHOXER1CES1CES2MEN1
SCHEMBL8415757 0.82
SCHEMBL25307541 0.80 PLA2G4A (0.33) FAAHOXER1CES1CES2MEN1
SCHEMBL565341 0.78 LMNA (0.53) OXER1MEN1CYP1A2KMT2AHSD17B10
SCHEMBL377071 0.78 FAAH (0.32) FAAHOXER1CES1CES2MEN1
SCHEMBL866440 0.78 FAAH (0.31) FAAHOXER1CES1CES2MEN1

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-0753085-A1 PROCESS FOR PREPARING BRANCHED PERFLUOROCHEMICALS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-01-15 EP disclosed
WO-1995026429-A1 PROCESS FOR PREPARING BRANCHED PERFLUOROCHEMICALS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-10-05 WO disclosed