SCHEMBL462009

SCHEMBL462009

CC(C)(C)OC(=O)NC1CN(Cc2ccccc2)CC1c1cccc(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
KMT2A Q03164 1/20 0.45
SCN9A Q15858 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
KDM1A O60341 2/20 0.40
MAOB P27338 1/20 0.40
JAK1 P23458 1/20 0.40
PDE4B Q07343 1/20 0.39
NPFFR1 Q9GZQ6 1/20 0.38
NPFFR2 Q9Y5X5 1/20 0.38
CHRM4 P08173 2/20 0.38
DRD2 P14416 4/20 0.37
DRD4 P21917 4/20 0.37
DRD3 P35462 4/20 0.37
NTRK1 P04629 1/20 0.37
MC1R Q01726 1/20 0.37

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
SCHEMBL462010 1.00 L3MBTL1 (0.45) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL462004 0.93 L3MBTL1 (0.47) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL462002 0.93 L3MBTL1 (0.47) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL143626 0.87 MC1R (0.49) L3MBTL1KMT2ASIGMAR1DRD2DRD3
SCHEMBL143625 0.87 MC1R (0.49) L3MBTL1KMT2ASIGMAR1DRD2DRD3
SCHEMBL143627 0.87 MC1R (0.49) L3MBTL1KMT2ASIGMAR1DRD2DRD3
SCHEMBL147898 0.87 L3MBTL1 (0.46) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL147897 0.87 L3MBTL1 (0.46) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL147896 0.87 L3MBTL1 (0.46) L3MBTL1KMT2ASCN9ASIGMAR1KDM1A
SCHEMBL461990 0.87 KMT2A (0.44) L3MBTL1KMT2ASIGMAR1KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed