SCHEMBL7757145

SCHEMBL7757145

CCCCCC(F)(CC1CC1)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.40
LPAR1 Q92633 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.36
FAAH O00519 8/20 0.35
CES1 P23141 5/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FDPS P14324 1/20 0.33
PKM P14618 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
SCHEMBL7757158 0.95 LMNA (0.37) CES2HTTLMNAMAPK1MAPT
SCHEMBL7761145 0.88 CYP2C9 (0.34) HTTLMNAMAPK1MAPTHSD17B10
SCHEMBL7761197 0.78 CES2 (0.47) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7757136 0.78 CES2 (0.47) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7760148 0.76 CES2 (0.42) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7761964 0.72 CES2 (0.42) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7757123 0.72 CES2 (0.39) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7757124 0.72 CES2 (0.39) CES2LPAR1LPAR3LMNAFAAH
SCHEMBL4830272 0.70 CES2 (0.61) CES2LPAR1LPAR3FAAHCES1
SCHEMBL7763703 0.70 CES2 (0.40) 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