SCHEMBL459767

SCHEMBL459767

NCCNc1ccc(N)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.55
CYP3A4 P08684 2/20 0.45
MAPT P10636 6/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RAB9A P51151 1/20 0.39
IDO1 P14902 2/20 0.38
RAD52 P43351 1/20 0.38
GAA P10253 1/20 0.38
ADRA2B P18089 1/20 0.38

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
Bromide SCHEMBL11679020 0.98 APP (0.53) APPCYP3A4MAPTMAOAMAOB
Bromide SCHEMBL11699530 0.98 APP (0.53) APPCYP3A4MAPTMAOAMAOB
Ethylene Glycol SCHEMBL2849842 0.89 APP (0.47) APPCYP3A4MAPTMAOAMAOB
SCHEMBL180817 0.87 APP (0.55) APPCYP3A4MAPTMAOAMAOB
SCHEMBL9155154 0.86 APP (0.52) APPMAPTMAOAMAOBALDH1A1
Hydrochloric Acid SCHEMBL4952599 0.84 APP (0.53) APPCYP3A4MAPTMAOAMAOB
SCHEMBL457665 0.84 APP (0.50) APPMAPTMAOAMAOBALDH1A1
SCHEMBL28385928 0.82 APP (0.49) APPMAPTMAOAMAOBALDH1A1
SCHEMBL11934926 0.82 APP (0.49) APPMAPTMAOAMAOBALDH1A1
SCHEMBL2024986 0.82 MAPT (0.56) APPCYP3A4MAPTMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101444460-B Oxidation dye composition, oxidation dyeing process and use OU LAIYA 2013-08-14 CN claimed
CN-1882307-A Method for dyeing fibres containing keratine HENKEL KGAA (DE) 2006-12-20 CN claimed
US-7060112-B2 Composition for the oxidation dyeing of keratinous fibers containing a laccase and dyeing method using this composition L'OREAL (FR) 2006-06-13 US claimed
EP-1299072-B1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES COMPRISING AN AMPHOTERIC POLYMER WITH FATTY CHAIN OREAL (FR) 2005-11-16 EP claimed
CN-1210012-C Composition for oxidation dyeing keratoprotein fibre and method for dyeing using said composition OREAL (FR) 2005-07-13 CN claimed
CN-1203836-C Keratinous fibre oxidation dyeing composition contg laccase and dyeing method using same OREAL (FR) 2005-06-01 CN claimed
CN-1201717-C Composite for oxidation-dyeing keratin fibre and its dyeing method OREAL (FR) 2005-05-18 CN claimed
CN-1200682-C Keratin-fiber oxidation dyeing composition and dyeing method using same OREAL (FR) 2005-05-11 CN claimed
CN-1198570-C Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2005-04-27 CN claimed
CN-1195480-C Oxidation dyeing composition for keratin fibers and dyeing method using said composition OREAL (FR) 2005-04-06 CN claimed
CN-1241138-A Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2000-01-12 CN claimed
CN-1241136-A Oxidation dye composition for keratin fibres OREAL (FR) 2000-01-12 CN claimed
CN-1241135-A Oxidation dyeing composition for keratin fibres OREAL (FR) 2000-01-12 CN claimed
CN-1239422-A Oxidation dyeing compsn. for keratin fibres and dyeing method of using same OREAL (FR) 1999-12-22 CN claimed
EP-0589952-B1 USE OF SUPLHUR METAAMINOPHENOLS FOR DYEING KERATINIC FIBRES, TINCTORIAL COMPOSITIONS AND NOVEL COMPOUNDS OREAL (FR) 1997-08-27 EP claimed
CN-1137374-A Composition for oxidation dyeing of keratin fibers, comprising oxidation base, indole coupler and additional heterocyclic coupler, and dyeing process OREAL (FR) 1996-12-11 CN claimed
CN-1137375-A Composition for oxidation dyeing of keratin fibres, comprising at least two oxidation bases and dation be coupler, and dyeing process OREAL (FR) 1996-12-11 CN claimed
CN-1051668-A Contain the dyeing composition for keratinous fibres of oxidation colorant parent and 4-hydroxy indoxyl derivative colour former and use the staining that said composition is carried out OREAL (FR) 1991-05-29 CN claimed
CN-1051670-A Contain the dyeing composition for keratinous fibres of oxidation dye parent and amino indole colour former, the colouring method that uses these compositionss and noval chemical compound OREAL (FR) 1991-05-29 CN claimed
EP-0428442-A1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same L'OREAL (FR) 1991-05-22 EP claimed