SCHEMBL5051925

SCHEMBL5051925

CC(CNC(=O)c1c(F)c(F)c(F)c(F)c1F)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 1/20 0.49
TAS1R2 Q8TE23 1/20 0.49
TDP1 Q9NUW8 1/20 0.45
BRD4 O60885 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.42
TP53 P04637 2/20 0.41
MDM2 Q00987 1/20 0.41
P2RX7 Q99572 2/20 0.41
HTT P42858 1/20 0.41
PKM P14618 1/20 0.41
HSD17B10 Q99714 1/20 0.40
CCKAR P32238 1/20 0.40
CCKBR P32239 1/20 0.40

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
SCHEMBL5051934 0.83 KMT2A (0.56) RAB9ANPC1TAS1R3TAS1R1TAS1R2
SCHEMBL4072352 0.74 HPGD (0.49) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4172967 0.73 TAS1R3 (0.82) TAS1R3TAS1R1TAS1R2SMN1; SMN2KMT2A
SCHEMBL7898468 0.73 HPGD (0.46) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL5141570 0.72 MAPK1 (0.46) TAS1R3TAS1R1TAS1R2SMN1; SMN2MEN1
SCHEMBL4965217 0.71 SMN1; SMN2 (0.54) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL1811166 0.71 SMN1; SMN2 (0.55) RAB9ANPC1TAS1R3TAS1R1TAS1R2
SCHEMBL4081360 0.70 POLB (0.54) RAB9ANPC1SMN1; SMN2HPGDTSHR
SCHEMBL5244808 0.68 TAAR1 (0.61) TDP1SMN1; SMN2KMT2ATSHRALDH1A1
SCHEMBL29321255 0.68 TAAR1 (0.61) TDP1SMN1; SMN2KMT2ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960350-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-08-27 EP claimed
WO-2007060162-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2007-05-31 WO claimed
EP-1960350-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-08-27 EP disclosed
WO-2007060162-A1 NEW N-(1-METHYL-2PHENYLETHYL)BENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2007-05-31 WO disclosed