SCHEMBL7761145

SCHEMBL7761145

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

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.34
HSD11B1 P28845 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
MAPT P10636 1/20 0.32
LMNA P02545 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
LIPA P38571 1/20 0.31
MLYCD O95822 1/20 0.31
ALOX5 P09917 1/20 0.31
CNR2 P34972 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
SCHEMBL7757158 0.89 LMNA (0.37) CYP2C9HSD11B1MAPTLMNAMAPK1
SCHEMBL7757145 0.88 CES2 (0.40) MAPTLMNAMAPK1HTTHSD17B10
SCHEMBL7760151 0.80 HSD17B10 (0.40) LMNAHSD17B10
SCHEMBL27571528 0.76 HSD17B10 (0.38) THRBLMNAHSD17B10
SCHEMBL7757124 0.72 CES2 (0.39) LMNAHSD17B10
SCHEMBL14795277 0.71 THRA (0.42) CYP2C9HSD11B1THRATHRBLMNA
SCHEMBL30281253 0.71 TDP1 (0.38) HSD11B1THRATHRBLMNATDP1
SCHEMBL14795141 0.71 THRA (0.42) CYP2C9HSD11B1THRATHRBLMNA
SCHEMBL14795101 0.71 THRA (0.42) CYP2C9HSD11B1THRATHRBLMNA
SCHEMBL7757136 0.71 CES2 (0.47) HSD17B10

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