SCHEMBL7763703

SCHEMBL7763703

CCCCCC(F)(C(N)=O)C1CCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.40
LPAR1 Q92633 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
FAAH O00519 8/20 0.35
CES1 P23141 5/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EPHX1 P07099 2/20 0.34
BCHE P06276 1/20 0.34
FDPS P14324 1/20 0.33

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
SCHEMBL7761183 0.95 CES2 (0.33) CES2FAAHCES1MEN1CYP1A2
SCHEMBL7761964 0.93 CES2 (0.42) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7761147 0.88 LMNA (0.32) HSD17B10EPHX1
SCHEMBL7763686 0.88 CES2 (0.35) CES2FAAHCES1MEN1CYP1A2
SCHEMBL7760136 0.80 LMNA (0.33) HSD17B10
SCHEMBL28333420 0.73 NAAA (0.41) CYP1A2EPHX1BCHE
SCHEMBL20683522 0.71 ARG1 (0.51) FDPS
SCHEMBL4830272 0.70 CES2 (0.61) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7757145 0.70 CES2 (0.40) CES2LPAR1LPAR3FAAHCES1
Hydrochloric Acid SCHEMBL3239446 0.69 CES2 (0.59) CES2LPAR1LPAR3FAAHCES1

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-1089962-A1 2-FLUORO-2-ALKYL ALKANOAMIDES WITH ANTICONVULSANT ACTIVITY AMERICAN BIOGENETIC SCIENCES, INC. (US) 2001-04-11 EP disclosed
WO-1999067199-A1 2-FLUORO-2-ALKYL ALKANOAMIDES WITH ANTICONVULSANT ACTIVITY AMERICAN BIOGENETIC SCIENCES INC. (US) 1999-12-29 WO disclosed