SCHEMBL3466993

SCHEMBL3466993

O=C(O)CC1Cc2cc(-c3ccc(F)cc3)ccc2NC1=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 1/20 0.38
DGAT1 O75907 2/20 0.37
MAOB P27338 2/20 0.37
KIF11 P52732 1/20 0.36
PGR P06401 1/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
HTR2A P28223 1/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
GRIA1 P42261 1/20 0.35
HTT P42858 1/20 0.34
GPR17 Q13304 1/20 0.34
PPARD Q03181 1/20 0.34

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
SCHEMBL3467451 0.90 OTUD7B (0.41) OTUD7BPGRPPARGPPARAPPARD
SCHEMBL3467479 0.89 ALDH1A1 (0.38) DGAT1KIF11PGRPDE3BPDE3A
SCHEMBL3466901 0.88 PGR (0.41) DGAT1PGRPDE3BPDE3A
SCHEMBL3467737 0.87 TDP2 (0.46) DGAT1HTR2APPARG
SCHEMBL3308412 0.87 KIF11 (0.53) DGAT1KIF11PDE3BPDE3APPARA
SCHEMBL3467229 0.86 FFAR1 (0.38) DGAT1PGR
SCHEMBL3468501 0.86 TDP2 (0.44) PGR
SCHEMBL3467216 0.84 PYGL (0.41) DGAT1MAOBPGRPDE3BPDE3A
SCHEMBL3467198 0.84 PPARA (0.47) KIF11PPARGPPARAGRIA1PPARD
SCHEMBL3466924 0.84 KIF11 (0.41) KIF11

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
WO-2010074807-A1 3, 4-DIHYDROQUINOLIN-2 ( 1H ) -ONE DERIVATIVES AS SODIUM CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-07-01 WO claimed
WO-2010074807-A1 3, 4-DIHYDROQUINOLIN-2 ( 1H ) -ONE DERIVATIVES AS SODIUM CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-07-01 WO disclosed