SCHEMBL5807900

SCHEMBL5807900

COC(=O)c1ccc(C=C(CNc2ccc(OC)c(OC)c2)COc2nc3ccccc3s2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.48
MAPT P10636 8/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 6/20 0.44
HTT P42858 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 3/20 0.44
HPGD P15428 2/20 0.44
PKM P14618 1/20 0.44
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
GPX4 P36969 2/20 0.42
RAB9A P51151 4/20 0.42
GAA P10253 1/20 0.42
PPARG P37231 1/20 0.42
NR2E3 Q9Y5X4 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
SCHEMBL5807897 1.00 GLO1 (0.48) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5813996 0.93 KDM4E (0.46) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5814003 0.93 KDM4E (0.46) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5797405 0.92 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5797406 0.92 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5819439 0.86 GLO1 (0.49) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5798959 0.86 GLO1 (0.49) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5799757 0.83 GLO1 (0.59) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5799023 0.81 GLO1 (0.57) GLO1MAPTMEN1KMT2AALDH1A1
SCHEMBL5799017 0.81 GLO1 (0.57) GLO1MAPTMEN1KMT2AALDH1A1

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-2006025683-A1 ARYLAMINOMETHYL PROPENYL BENZHYDROXYAMID DERIVATIVES WITH INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND METHOD FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-03-09 WO disclosed