SCHEMBL16474289

SCHEMBL16474289

CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.47
KDM1A O60341 1/20 0.47
FKBP1A P62942 4/20 0.45
ABCB1 P08183 1/20 0.45
CYP1A2 P05177 1/20 0.44
OPRD1 P41143 1/20 0.44
SYK P43405 1/20 0.44
CTSL P07711 1/20 0.44
PREP P48147 2/20 0.44
BACE1 P56817 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL20528094 0.88 KDM1A (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL20522962 0.88 KDM1A (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL30511036 0.88 KDM1A (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL3086475 0.87 CTSK (0.53) CTSL
SCHEMBL4738328 0.85 OPRD1 (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL336766 0.85 OPRD1 (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL337363 0.85 OPRD1 (0.53) PRMT5KDM1AFKBP1AABCB1OPRD1
SCHEMBL12496208 0.82 FKBP1A (0.52) PRMT5KDM1AFKBP1AOPRD1SYK
SCHEMBL7934451 0.79 KDM1A (0.39) PRMT5KDM1AOPRD1ATM
SCHEMBL30511007 0.79 OPRD1 (0.49) FKBP1AOPRD1SYKCTSLPREP

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
EP-2312947-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2014-01-01 EP disclosed