SCHEMBL463400

SCHEMBL463400

CC(C)(C)OC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1c1ccc(Cl)cc1F

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.50
USP30 Q70CQ3 4/20 0.48
KDM4D Q6B0I6 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP3A5 P20815 2/20 0.41
FPR1 P21462 3/20 0.40
FPR2 P25090 3/20 0.40
STS P08842 1/20 0.40
MKNK1 Q9BUB5 1/20 0.39
DPP4 P27487 1/20 0.39
KDM1A O60341 1/20 0.39
CNR1 P21554 1/20 0.39
MC4R P32245 1/20 0.39

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
SCHEMBL463401 1.00 PDE4B (0.50) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL463402 1.00 PDE4B (0.50) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL470579 0.93 PDE4B (0.51) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL462446 0.93 PDE4B (0.51) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL457321 0.84 PDE4B (0.42) PDE4BUSP30KDM4DFPR1FPR2
SCHEMBL470457 0.83 DPP4 (0.57) PDE4BUSP30CYP3A4CYP3A5STS
SCHEMBL461990 0.81 KMT2A (0.44) PDE4BKDM4DFPR1FPR2DPP4
SCHEMBL461989 0.81 KMT2A (0.44) PDE4BKDM4DFPR1FPR2DPP4
SCHEMBL462835 0.80 FPR1 (0.46) KDM4DFPR1FPR2KDM1A
SCHEMBL462837 0.80 FPR1 (0.46) KDM4DFPR1FPR2KDM1A

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