SCHEMBL8314172

SCHEMBL8314172

CCOC(=O)/C=C/c1cccc(C(NC(C)=O)c2ccc(N(C)C)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
MAPT P10636 2/20 0.47
MDM4 O15151 1/20 0.47
MDM2 Q00987 1/20 0.47
NR1H4 Q96RI1 4/20 0.44
TTR P02766 1/20 0.43
DPP4 P27487 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAOB P27338 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
RECQL P46063 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
SCHEMBL8317737 0.87 LMNA (0.55) LMNAMAPTMDM4MDM2TTR
SCHEMBL8313475 0.85 ALDH1A1 (0.48) LMNAMAPTNR1H4ALDH1A1MEN1
SCHEMBL8320373 0.83 HDAC1 (0.57) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL8317483 0.80 ALDH1A1 (0.52) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL8321364 0.78 MAPT (0.50) LMNAMAPTMDM4MDM2ALDH1A1
SCHEMBL8317750 0.76 ALDH1A1 (0.59) LMNAMAPTALDH1A1MAOBMEN1
SCHEMBL28161744 0.75 TTR (0.57) MAPTTTRDPP4ALDH1A1MAOB
SCHEMBL13957063 0.74 CA12 (0.69) LMNAMAPTTTRDPP4ALDH1A1
SCHEMBL10851526 0.74 CA12 (0.69) LMNAMAPTTTRDPP4ALDH1A1
SCHEMBL10888420 0.74 CA12 (0.69) LMNAMAPTTTRDPP4ALDH1A1

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-2004071401-A2 HYDROXAMIC ACID DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS (HDCA) FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-26 WO disclosed