SCHEMBL7761139

SCHEMBL7761139

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

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.34
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
LIPA P38571 1/20 0.32
ALOX5 P09917 1/20 0.31
CHRM3 P20309 1/20 0.31
CNR2 P34972 1/20 0.30
SLC1A3 P43003 2/20 0.30
SLC1A2 P43004 2/20 0.30
SLC1A1 P43005 2/20 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
SCHEMBL7757159 0.93 ALOX5 (0.35) HSD11B1ALOX5CHRM3SLC1A3SLC1A2
SCHEMBL7760175 0.84 MAPT (0.33) HSD11B1THRATHRBMAPT
SCHEMBL7763689 0.78 ALOX5 (0.33) ALOX5SLC1A3SLC1A2SLC1A1
SCHEMBL14795277 0.73 THRA (0.42) HSD11B1THRATHRBTDP1LIPA
SCHEMBL30281253 0.73 TDP1 (0.38) HSD11B1THRATHRBTDP1LIPA
SCHEMBL14795141 0.73 THRA (0.42) HSD11B1THRATHRBTDP1LIPA
SCHEMBL14795101 0.73 THRA (0.42) HSD11B1THRATHRBTDP1LIPA
SCHEMBL7761232 0.72 MAPT (0.36) MAPTLIPA
SCHEMBL27564736 0.69 LMNA (0.35) TDP1
SCHEMBL4185298 0.69 HSD11B1 (0.47) HSD11B1THRATHRBMAPTTDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1306503-A 2-fluoro-2-alkyl alkanoamides with anticonvulsant activity HEINZ NAU (DE) 2001-08-01 CN disclosed
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