SCHEMBL470457

SCHEMBL470457

CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2F)[C@@H](N)C1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.57
USP30 Q70CQ3 2/20 0.49
CYP3A4 P08684 2/20 0.44
CYP3A5 P20815 2/20 0.44
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
RORC P51449 1/20 0.41
CNR1 P21554 1/20 0.41
MC4R P32245 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
STS P08842 1/20 0.40
PDE4B Q07343 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
SCHEMBL1968429 0.88 DPP4 (0.46) DPP4USP30RORCMC4RPDE4B
SCHEMBL148144 0.83 RORC (0.49) DPP4USP30RORCMEN1KMT2A
SCHEMBL148143 0.83 RORC (0.49) DPP4USP30RORCMEN1KMT2A
SCHEMBL148142 0.83 RORC (0.49) DPP4USP30RORCMEN1KMT2A
SCHEMBL1725669 0.83 RORC (0.49) DPP4USP30RORCMEN1KMT2A
SCHEMBL463402 0.83 PDE4B (0.50) DPP4USP30CYP3A4CYP3A5CNR1
SCHEMBL463401 0.83 PDE4B (0.50) DPP4USP30CYP3A4CYP3A5CNR1
SCHEMBL463400 0.83 PDE4B (0.50) DPP4USP30CYP3A4CYP3A5CNR1
SCHEMBL528928 0.82 PDE4B (0.47) DPP4USP30RORCMC4RPDE4B
SCHEMBL528371 0.82 DPP4 (0.49) DPP4USP30RORCSTS

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