SCHEMBL458294

SCHEMBL458294

CC(C)(C)OC(=O)N[C@@]1(Cc2ccccc2)CNC[C@@H]1N

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CTSL P07711 4/20 0.39
CTSS P25774 4/20 0.39
CTSB P07858 3/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AKT1 P31749 2/20 0.38
EPHX2 P34913 1/20 0.37
GRIN2B Q13224 1/20 0.37
ATM Q13315 1/20 0.37
IDO1 P14902 1/20 0.36
CTSK P43235 1/20 0.35
SSTR4 P31391 1/20 0.35
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
SYK P43405 1/20 0.35

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
SCHEMBL18342304 0.83 MC4R (0.39) KMT2AEPHX2SSTR4
SCHEMBL1720924 0.83 MC4R (0.39) KMT2AEPHX2SSTR4
SCHEMBL2012019 0.81 KDM1A (0.39) CA12CA1CA7CA14KMT2A
SCHEMBL462003 0.81 IDO1 (0.36) CA12CA1CA7CA14CTSL
SCHEMBL462095 0.79 RORC (0.36) CA12CA1CA7CA14CTSL
SCHEMBL2013227 0.79 CA12 (0.34) CA12CA1CA7CA14CTSL
SCHEMBL2226908 0.79 KMT2A (0.36) CA12CA1CA7CA14KMT2A
SCHEMBL1721451 0.79 AKT1 (0.37) CA12CA1CA7CA14CTSL
SCHEMBL2480628 0.79 KMT2A (0.40) CA12CA1CA7CA14CTSL
SCHEMBL2476094 0.79 KMT2A (0.40) CA12CA1CA7CA14CTSL

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