SCHEMBL462446

SCHEMBL462446

CC(C)(C)OC(=O)NC1CN(C(=O)OC(C)(C)C)C[C@@H]1c1cc(Cl)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.51
USP30 Q70CQ3 4/20 0.47
KDM4D Q6B0I6 1/20 0.40
CYP3A4 P08684 2/20 0.40
CYP3A5 P20815 2/20 0.40
KDM1A O60341 1/20 0.39
RORC P51449 1/20 0.39
BACE1 P56817 1/20 0.39
STS P08842 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
ANO1 Q5XXA6 1/20 0.38

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
SCHEMBL470579 1.00 PDE4B (0.51) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL463400 0.93 PDE4B (0.50) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL463402 0.93 PDE4B (0.50) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL463401 0.93 PDE4B (0.50) PDE4BUSP30KDM4DCYP3A4CYP3A5
SCHEMBL457321 0.92 PDE4B (0.42) PDE4BUSP30KDM4DKDM1A
SCHEMBL19203135 0.76 PDE4B (0.59) PDE4BUSP30KDM1ARORC
SCHEMBL5924054 0.76 DPP4 (0.49) PDE4BMEN1KMT2A
SCHEMBL470457 0.75 DPP4 (0.57) PDE4BUSP30CYP3A4CYP3A5RORC
SCHEMBL461989 0.74 KMT2A (0.44) PDE4BKDM4DKDM1AKMT2A
SCHEMBL461990 0.74 KMT2A (0.44) PDE4BKDM4DKDM1AKMT2A

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