SCHEMBL457232

SCHEMBL457232

CC(C)(C)OC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1c1cc(CF)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SIGMAR1 Q99720 5/20 0.41
PDE4B Q07343 1/20 0.39
JAK1 P23458 1/20 0.39
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.38
ATM Q13315 1/20 0.38
DRD2 P14416 4/20 0.38
DRD4 P21917 4/20 0.38
DRD3 P35462 4/20 0.38
SCN9A Q15858 1/20 0.38
DPP4 P27487 1/20 0.38
S1PR5 Q9H228 1/20 0.37
NPFFR1 Q9GZQ6 1/20 0.37
NPFFR2 Q9Y5X5 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
SCHEMBL457234 1.00 KMT2A (0.43) KMT2AL3MBTL1SIGMAR1PDE4BJAK1
SCHEMBL462316 0.93 KMT2A (0.43) KMT2AL3MBTL1SIGMAR1PDE4BJAK1
SCHEMBL462317 0.93 KMT2A (0.43) KMT2AL3MBTL1SIGMAR1PDE4BJAK1
SCHEMBL147672 0.91 KMT2A (0.48) KMT2AL3MBTL1SIGMAR1MEN1ATM
SCHEMBL147671 0.91 KMT2A (0.48) KMT2AL3MBTL1SIGMAR1MEN1ATM
SCHEMBL147670 0.91 KMT2A (0.48) KMT2AL3MBTL1SIGMAR1MEN1ATM
SCHEMBL459501 0.90 KMT2A (0.44) KMT2AL3MBTL1SIGMAR1PDE4BKDM1A
SCHEMBL459499 0.90 KMT2A (0.44) KMT2AL3MBTL1SIGMAR1PDE4BKDM1A
SCHEMBL147898 0.89 L3MBTL1 (0.46) KMT2AL3MBTL1SIGMAR1PDE4BJAK1
SCHEMBL147896 0.89 L3MBTL1 (0.46) KMT2AL3MBTL1SIGMAR1PDE4BJAK1

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