SCHEMBL1979093

SCHEMBL1979093

CCON(N)c1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 7/20 0.50
TDP1 Q9NUW8 6/20 0.50
ALDH1A1 P00352 5/20 0.50
TSHR P16473 3/20 0.50
MAPK1 P28482 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PSMD14 O00487 1/20 0.50
RECQL P46063 1/20 0.50
GFER P55789 1/20 0.50
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP1A2 P05177 4/20 0.41
MAPT P10636 4/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 3/20 0.38
MAOA P21397 1/20 0.38
MEN1 O00255 1/20 0.35

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
SCHEMBL11386184 0.80 TP53 (0.41) CYP3A4TDP1ALDH1A1TSHRL3MBTL1
SCHEMBL27571352 0.80 TDP1 (0.52) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL2553985 0.77 TDP1 (0.48) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL6816251 0.77 TDP1 (0.54) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL10442224 0.75 TDP1 (0.47) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL8772724 0.72 TDP1 (0.48) CYP3A4TDP1ALDH1A1TSHRMAPK1
Sulfuric Acid SCHEMBL28070216 0.71 ALDH1A1 (0.42) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL27496182 0.71 CYP3A4 (0.42) CYP3A4TDP1ALDH1A1TSHRMAPK1
SCHEMBL27885808 0.70 TDP1 (0.41) CYP3A4TDP1ALDH1A1TSHRMAPK1
Butane SCHEMBL2511845 0.69 MAPT (0.61) CYP3A4TDP1ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108495686-A Composition for handling hair 欧莱雅 2018-09-04 CN disclosed
CN-108495687-A Composition for handling hair 欧莱雅 2018-09-04 CN disclosed
CN-107949366-A Multi-step hair dyeing process using at least one titanium salt and synthetic direct dye 莱雅公司 2018-04-20 CN disclosed
CN-107049807-A For dyeing keratinous fibres and/or the double reagent of bleaching 欧莱雅 2017-08-18 CN disclosed
EP-2509951-A1 NOVEL CATIONIC AMINOPYRIDINES, DYE COMPOSITION COMPRISING A CATIONIC AMINOPYRIDINE, PROCESSES THEREFOR AND USES THEREOF L'Oréal (FR) 2012-10-17 EP disclosed
EP-2509977-A1 NOVEL CATIONIC 4-AMINOINDOLES, DYE COMPOSITION COMPRISING A CATIONIC 4-AMINOINDOLE, PROCESSES THEREFOR AND USES THEREOF L'Oréal (FR) 2012-10-17 EP disclosed
WO-2011069952-A1 NOVEL CATIONIC 4-AMINOINDOLES, DYE COMPOSITION COMPRISING A CATIONIC 4-AMINOINDOLE, PROCESSES THEREFOR AND USES THEREOF L'OREAL (FR) 2011-06-16 WO disclosed
WO-2011069898-A1 NOVEL CATIONIC AMINOPYRIDINES, DYE COMPOSITION COMPRISING A CATIONIC AMINOPYRIDINE, PROCESSES THEREFOR AND USES THEREOF L'OREAL (FR) 2011-06-16 WO disclosed
EP-1868687-A1 AQUEOUS COMPOSITION COMPRISING HYDROGEN PEROXIDE AND INERT PARTICLES L'Oréal (FR) 2007-12-26 EP disclosed
WO-2006106000-A1 AQUEOUS COMPOSITION COMPRISING HYDROGEN PEROXIDE AND INERT PARTICLES L'ORÉAL (FR) 2006-10-12 WO disclosed