SCHEMBL1138792

SCHEMBL1138792

COc1ccc(/N=N/c2c(C)c(C#N)c(=O)n(CCCC(=O)O)c2O)c([N+](=O)[O-])c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 6/20 0.36
PKM P14618 1/20 0.36
CNR2 P34972 4/20 0.35
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
DYRK1A Q13627 1/20 0.35
CNR1 P21554 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
HPGD P15428 1/20 0.34
MITF O75030 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL1138794 1.00 MAPT (0.39) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL12866133 0.88 ALDH1A1 (0.41) MAPTMEN1KMT2AALDH1A1CNR2
SCHEMBL12693449 0.87 MAPT (0.39) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL14115925 0.87 MAPT (0.39) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL15694956 0.87 MAPT (0.36) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL12693434 0.86 ALDH1A1 (0.42) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL9816812 0.81 MAPT (0.34) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL12856596 0.79 ALDH1A1 (0.39) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL15694964 0.78 ALDH1A1 (0.35) MAPTMEN1KMT2AALDH1A1CNR2
SCHEMBL15693776 0.78 KMT2A (0.42) MAPTMEN1KMT2AALDH1A1PKM

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8696766-B2 Azopyridone disperse dyes, their preparation and use DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2014-04-15 US disclosed
EP-2350201-B1 AZOPYRIDONE DISPERSE DYES, THEIR PREPARATION AND USE DYSTAR COLOURS DISTRIB GMBH (DE) 2012-11-07 EP disclosed
EP-2350201-A1 AZOPYRIDONE DISPERSE DYES, THEIR PREPARATION AND USE DyStar Colours Deutschland GmbH (DE) 2011-08-03 EP disclosed
US-20110030153-A1 AZOPYRIDONE DISPERSE DYES, THEIR PREPARATION AND USE DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2011-02-10 US disclosed
WO-2009118260-A1 AZOPYRIDONE DISPERSE DYES, THEIR PREPARATION AND USE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-10-01 WO disclosed