SCHEMBL16486263

SCHEMBL16486263

CCOC(=O)NCC[C]=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.44
KMT2A Q03164 2/20 0.44
GLA P06280 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
NCOR2 Q9Y618 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
SCHEMBL7351529 0.84 ACHE (0.55) ACHEKMT2AL3MBTL1MEN1ALDH1A1
SCHEMBL29834112 0.82 ACHE (0.54) ACHEKMT2AGLAL3MBTL1GAA
SCHEMBL9194193 0.82 KMT2A (0.47) ACHEKMT2AGLAL3MBTL1GAA
SCHEMBL6493216 0.82 KMT2A (0.42) ACHEKMT2AGLAL3MBTL1GAA
SCHEMBL6539633 0.81 ACHE (0.62) ACHE
SCHEMBL300057 0.80
SCHEMBL294319 0.80
SCHEMBL6538858 0.79 SMN1; SMN2 (0.46) ACHEALDH1A1
SCHEMBL7570219 0.78 ACHE (0.61) ACHEKMT2AGLAHDAC3HDAC4
SCHEMBL21068069 0.78 ACHE (0.61) ACHEKMT2AGLAHDAC3HDAC4

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-2015023958-A1 TOLL-LIKE RECEPTOR AGONISTS THE UNIVERSITY OF KANSAS (US) 2015-02-19 WO disclosed