SCHEMBL1906434

SCHEMBL1906434

COc1cc2c(cc1NC(=O)CC(C)=O)=NC(=O)C(=O)N=2

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HTT P42858 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
AHR P35869 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL10386021 0.91 ALDH1A1 (0.55) ALDH1A1KMT2AMEN1SMN1; SMN2NPSR1
SCHEMBL7584127 0.86 KDM4E (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL2914361 0.83 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1SMN1; SMN2NPSR1
SCHEMBL7586545 0.81 MAPT (0.45) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL7592680 0.79 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL11571144 0.78 KDM4E (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL2911518 0.76 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL8752088 0.76 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1SMN1; SMN2HTT
SCHEMBL11576993 0.76 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL27858783 0.75 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1SMN1; SMN2HTT

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11100519-A None JP disclosed
US-7999086-B2 Method of conditioning azo pigments containing carboxylic ester groups CLARIANT FINANCE (BVI) LIMITED (VG) 2011-08-16 US disclosed
EP-1960477-B1 NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS AGFA GRAPHICS NV (BE) 2011-05-04 EP disclosed
US-7637994-B2 Yellow pigments and non-aqueous pigment dispersions AGFA GRAPHICS NV (BE) 2009-12-29 US disclosed
US-20090198045-A1 Method of conditioning azo pigments containing carboxylic ester groups CLARIANT INTERNATIONAL LTD. 2009-08-06 US disclosed
US-20090025604-A1 NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS AGFA GRAPHICS NV (BE) 2009-01-29 US disclosed
EP-1960477-A1 NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS AGFA GRAPHICS NV (BE) 2008-08-27 EP disclosed
WO-2008034472-A1 NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS AGFA GRAPHICS N.V. (BE) 2008-03-27 WO disclosed
EP-1167461-B1 Process for conditioning organic pigments CLARIANT FINANCE BVI LTD (VG) 2007-09-19 EP disclosed
US-20070213516-A1 Process For Producing High-Purity Azo Dyes HOELLEIN VOLKER 2007-09-13 US disclosed
US-6835242-B2 Thermally treating a liquid prepigment suspension in a microreactor CLARIANT FINANCE (BVI) LIMITED (VG) 2004-12-28 US disclosed
US-20030164118-A1 Conditioning of organic pigments CLARIANT FINANCE (BVI) LIMITED 2003-09-04 US disclosed
WO-2003052000-A1 METHOD FOR PRODUCING FINE-PARTICLE AZO COLORANT PREPARATIONS FOR INK JET PRINTING CLARIANT GMBH (DE) 2003-06-26 WO disclosed
US-6562121-B2 Thermally treating a liquid prepigment suspension in a microreactor CLARIANT FINANCE (BVI) LIMITED (VG) 2003-05-13 US disclosed
EP-0894831-B1 Monoazo pigments of the quinoxaline-acetarylide type CLARIANT GMBH (DE) 2002-10-09 EP disclosed
US-20020014179-A1 Conditioning of organic pigments CLARIANT INTERNATIONAL LTD. 2002-02-07 US disclosed
EP-1167461-A2 Process for conditioning organic pigments CLARIANT INTERNATIONAL LTD. (CH) 2002-01-02 EP disclosed
US-5910577-A YELLOW HUE, GREATER LIGHT AND WEATHER FASTNESS CLARIANT GMBH (DE) 1999-06-08 US disclosed
JP-H11100519-A QUINOXALINE-MONOAZO-ACETARYLIDE PIGMENT CLARIANT GMBH 1999-04-13 JP disclosed
EP-0894831-A1 Monoazo pigments of the quinoxaline-acetarylide type Clariant GmbH (DE) 1999-02-03 EP disclosed