SCHEMBL2009452

SCHEMBL2009452

COCCN(CCOC)c1cccc(NC(C)=O)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.48
MTNR1B P49286 3/20 0.48
POLB P06746 2/20 0.48
NR4A1 P22736 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK1 P28482 1/20 0.47
TSHR P16473 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
BTK Q06187 1/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL11051618 0.93 POLB (0.48) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL11800911 0.92 MEN1 (0.52) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL11327861 0.89 RAB9A (0.46) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL5281037 0.87 RAB9A (0.47) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL12711552 0.87 HTR7 (0.53) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL11225999 0.86 MEN1 (0.57) POLBNR4A1RAB9AALDH1A1CYP1A2
SCHEMBL11799305 0.86 RAB9A (0.52) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL11795444 0.85 RAB9A (0.58) POLBRAB9AMAPK1MEN1KMT2A
SCHEMBL11021269 0.84 POLB (0.47) MTNR1AMTNR1BPOLBNR4A1RAB9A
SCHEMBL9874122 0.84 POLB (0.43) POLBNR4A1RAB9AALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60137966-A None JP disclosed
EP-2513229-B1 DISPERSE AZO DYES, A PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF HUNTSMAN ADV MAT SWITZERLAND (CH) 2014-04-23 EP disclosed
EP-1560883-B1 PHTHALIMIDYL-AZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE HUNTSMAN ADV MAT SWITZERLAND (CH) 2013-07-10 EP disclosed
EP-2513229-A1 DISPERSE AZO DYES, A PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF Huntsman Advanced Materials (Switzerland) GmbH (CH) 2012-10-24 EP disclosed
WO-2011072966-A1 DISPERSE AZO DYES, A PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF HUNSTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2011-06-23 WO disclosed
US-6673906-B1 β modified monoazo dye resistant to dyeing, its preparation and use DYSTAR TEXTIFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2004-01-06 US disclosed
EP-0722991-B1 Colour-fast monoazo dye, its manufacture and its use DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-08-02 EP disclosed
US-5569751-A DIAZOTIZATION; COUPLING HOECHST MITSUBISHI KASEI CO. (JP) 1996-10-29 US disclosed
EP-0722991-A1 Colour-fast monoazo dye, its manufacture and its use DyStar Japan Ltd. (JP) 1996-07-24 EP disclosed
EP-0167913-B1 AZO DYES BAYER AG (DE) 1990-03-14 EP disclosed
US-4773915-A Benzisothiazole azo dye for synthetic fibers BAYER AKTIENGESELLSCHAFT (DE) 1988-09-27 US disclosed
US-4681932-A Benzoisothiazole azo dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1987-07-21 US disclosed
JP-S60137966-A MONOAZO DYE FOR SYNTHETIC FIBER AND PRODUCTION THEREOF MITSUI TOATSU CHEM INC 1985-07-22 JP disclosed
US-3966399-A Azo disperse dye mixtures SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-06-29 US disclosed