SCHEMBL11049552

SCHEMBL11049552

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.47
POLB P06746 1/20 0.47
NR4A1 P22736 1/20 0.47
MAPT P10636 2/20 0.46
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
TSHR P16473 2/20 0.45
USP2 O75604 1/20 0.45
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45
MCL1 Q07820 1/20 0.45
NOX1 Q9Y5S8 1/20 0.45
HSD17B10 Q99714 2/20 0.43
CYP1A2 P05177 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CSNK2A1 P68400 1/20 0.42
IGLV6-57 P01721 1/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL5281037 0.93 RAB9A (0.47) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11520788 0.90 MEN1 (0.46) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11049540 0.90 RAB9A (0.48) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11877274 0.90 POLB (0.51) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11051618 0.88 POLB (0.48) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL15178919 0.88 RAB9A (0.43) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11054158 0.87 MEN1 (0.54) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11049544 0.86 MEN1 (0.47) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11671141 0.86 RAB9A (0.46) RAB9APOLBNR4A1MAPTKMT2A
SCHEMBL11044870 0.85 MTNR1A (0.52) RAB9AMAPTKMT2AALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4456551-A Azo dyes from 2-amino-5-alkylthio-1,3,4-thiadiazoles and N-acyloxyalkyl-m-acylamidoanilines EASTMAN KODAK COMPANY (US) 1984-06-26 US disclosed
US-4243584-A Monoazo dyestuffs containing diazo component substituted by disulfimide and trifluoromethyl groups BAYER AKTIENGESELLSCHAFT (DE) 1981-01-06 US disclosed
US-4159265-A Phenylazopyrazolo dyestuffs including disulfimide substituent BAYER AKTIENGESELLSCHAFT (DE) 1979-06-26 US disclosed
US-4039522-A Phthalimidyl-azo-m-acylamido-n-substituted aniline compounds and polyester fibers dyed therewith EASTMAN KODAK COMPANY (US) 1977-08-02 US disclosed
US-4036824-A Disazo dyestuffs containing A-O-alkylene-O-SO3 H group BAYER AKTIENGESELLSCHAFT (DT) 1977-07-19 US disclosed
US-4022763-A Sulfaphenyl-azo-phenyl-azo-aminophenyl dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed
US-3998805-A MONOAZO DYES; POLYESTERS; YELLOW, RED, OR ORANGE SHADES CIBA-GEIGY CORPORATION (US) 1976-12-21 US disclosed
US-3978039-A POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-24 US disclosed