SCHEMBL1710041

SCHEMBL1710041

CNC(=O)N(CC(=O)OCc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 1/20 0.43
SYK P43405 1/20 0.42
AKT1 P31749 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
PPARA Q07869 1/20 0.40
IDO1 P14902 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL27396622 0.90 L3MBTL1 (0.43) L3MBTL1ALDH1A1MAPK1SYKAKT1
SCHEMBL29077734 0.90 L3MBTL1 (0.50) L3MBTL1ALDH1A1MAPK1SYKAKT1
SCHEMBL13150768 0.85 L3MBTL1 (0.43) L3MBTL1ALDH1A1MAPK1SYKAKT1
SCHEMBL28131444 0.81 L3MBTL1 (0.43) L3MBTL1ALDH1A1MAPK1SYKAKT1
SCHEMBL7703626 0.80 ALDH1A1 (0.49) L3MBTL1ALDH1A1MAPK1SYKSMN1; SMN2
SCHEMBL418232 0.80 ALDH1A1 (0.51) L3MBTL1ALDH1A1MAPK1SYKAKT1
SCHEMBL1626511 0.79 L3MBTL1 (0.48) L3MBTL1ALDH1A1MAPK1SYKSMN1; SMN2
SCHEMBL27003934 0.78 HDAC3 (0.45) L3MBTL1ALDH1A1MAPK1SYKSMN1; SMN2
SCHEMBL31170532 0.77 L3MBTL1 (0.49) L3MBTL1ALDH1A1MAPK1SYKSMN1; SMN2
SCHEMBL24208084 0.77 BACE1 (0.42) L3MBTL1ALDH1A1MAPK1SYKSMN1; SMN2

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-2012047617-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2012-04-12 WO disclosed