SCHEMBL2954975

SCHEMBL2954975

CNC(=O)c1cccc(C(=O)N(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.65
HDAC6 Q9UBN7 2/20 0.65
SLC7A5 Q01650 1/20 0.49
PKM P14618 1/20 0.47
BRD4 O60885 1/20 0.47
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
ERN1 O75460 1/20 0.44
L3MBTL3 Q96JM7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 1/20 0.43
HDAC2 Q92769 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL5909363 0.86 HDAC8 (0.83) HDAC8HDAC6SLC7A5PKMPOLB
SCHEMBL7406706 0.86 MEN1 (0.55) CYP3A4CYP2C9KMT2AMEN1ERN1
SCHEMBL19704274 0.82 HDAC8 (0.61) HDAC8HDAC6SLC7A5PKMPOLB
SCHEMBL13701791 0.81 LMNA (0.52) LMNACYP3A4CYP2C9KMT2AMEN1
SCHEMBL13702339 0.81 SMN1; SMN2 (0.54) HDAC8HDAC6POLBCYP3A4KMT2A
SCHEMBL2128427 0.80 HDAC2 (0.59) HDAC8HDAC6BRD4CYP3A4GAA
SCHEMBL2645114 0.79 ERN1 (0.47) BRD4CYP3A4KMT2AMEN1ERN1
SCHEMBL2422043 0.79 HDAC8 (0.71) HDAC8HDAC6SLC7A5POLBLMNA
SCHEMBL1200585 0.79 HDAC8 (0.71) HDAC8HDAC6SLC7A5PKMCYP2C9
SCHEMBL1255459 0.79 MEN1 (0.53) POLBCYP2C9KMT2AMEN1ERN1

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
US-7763646-B2 Compounds for the treatment of alzheimer's disease ELAN PHARMACEUTICALS, INC. (US) 2010-07-27 US disclosed