SCHEMBL459124

SCHEMBL459124

NCCC(N)(O)c1ccc(N)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.40
TAAR1 Q96RJ0 2/20 0.38
PTGS1 P23219 3/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
FDPS P14324 1/20 0.34
MAOB P27338 3/20 0.34
EPHX2 P34913 1/20 0.34
HIF1A Q16665 2/20 0.33
CYP3A4 P08684 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
SLC22A8 Q8TCC7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA3 P07451 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
CA6 P23280 1/20 0.33

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
SCHEMBL27760612 0.76 CNR2 (0.49) MAPTCYP3A4ALDH1A1
SCHEMBL18106924 0.76 MAPT (0.46) KIF11MAPTMEN1KMT2AFDPS
SCHEMBL1822141 0.71 KIF11 (0.43) KIF11TAAR1LOXL2MAPTMEN1
SCHEMBL24272949 0.71 MAPT (0.50) KIF11TAAR1LOXL2MAPTMEN1
SCHEMBL17039751 0.71 MAPT (0.47) KIF11PTGS1MAPTMEN1KMT2A
SCHEMBL28325077 0.70 PRKACA (0.41) KIF11LOXL2MAPTMEN1KMT2A
SCHEMBL1463293 0.69 MAPT (0.44) KIF11TAAR1LOXL2MAPTMEN1
SCHEMBL301882 0.68 MAPT (0.50) KIF11PTGS1MAPTMEN1KMT2A
SCHEMBL9456971 0.67 MAPT (0.57) KIF11TAAR1LOXL2MAPTMEN1
Ethylenediamine SCHEMBL8661671 0.66 MEN1 (0.67) TAAR1LOXL2MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1493426-B1 Dyeing composition comprising a developer, 2-chloro-6-methyl-3-aminophenol and 3-methyl-1-phenyl-5-pyrazolone OREAL (FR) 2009-08-12 EP claimed
EP-1129689-B1 Keratinous fiber dyeing composition comprising N-(2-hydroxybenzene)-carbamate or N-(2-hydroxybenzene)urea derivatives as coupling agents and process for dyeing OREAL (FR) 2008-07-09 EP claimed
US-20030172472-A1 Oxidaton dyeing composition for keratinous fibres comprising an amphoteric polymer with fatty chain L'OREAL S.A. (FR) 2003-09-18 US claimed
EP-0989128-B1 4-Hydroxyindoles kationic and their use for oxidation dyeing of keratinous fibres OREAL (FR) 2001-03-21 EP claimed
CN-118103023-A Retarder composition and dye set comprising same 莱雅公司 2024-05-28 CN disclosed
CN-118043027-A Process for dyeing and/or lightening keratin fibres 莱雅公司 2024-05-14 CN disclosed
CN-112312883-B Device for dispensing hair coloring products using dye compositions and oxidizing compositions comprising scleroglucan gum 莱雅公司 2024-04-02 CN disclosed
CN-117715610-A Composition for simultaneously bleaching and dyeing keratin fibers and method for using same 莱雅公司 2024-03-15 CN disclosed
CN-117715615-A Composition comprising at least one oxidation dye, 1, 3-propanediol, at least one alkaline agent and at least one fatty substance 莱雅公司 2024-03-15 CN disclosed
CN-117651546-A Oxidation retardant composition 莱雅公司 2024-03-05 CN disclosed
CN-117615746-A Dye set 莱雅公司 2024-02-27 CN disclosed
CN-117597104-A Combination for dyeing keratin fibres and use thereof 莱雅公司 2024-02-23 CN disclosed
CN-1242699-A Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2000-01-26 CN disclosed
CN-1241135-A Oxidation dyeing composition for keratin fibres OREAL (FR) 2000-01-12 CN disclosed
CN-1241138-A Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2000-01-12 CN disclosed
CN-1241134-A Oxidising composition and uses for dyeing, permanently setting or bleaching keratin fibres OREAL (FR) 2000-01-12 CN disclosed
CN-1241136-A Oxidation dye composition for keratin fibres OREAL (FR) 2000-01-12 CN disclosed
CN-1241137-A Composition for the oxidation dyeing of keratin fibres and dyeing process using this composition OREAL (FR) 2000-01-12 CN disclosed
CN-1239422-A Oxidation dyeing compsn. for keratin fibres and dyeing method of using same OREAL (FR) 1999-12-22 CN disclosed
CN-1189820-A N-substituted 4-hydroxyindole derivatives and keratin fibre dyeing compsns. containing same OREAL (FR) 1998-08-05 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030172472-A1 Oxidaton dyeing composition for keratinous fibres comprising an amphoteric polymer with fatty chain KRT18, MB, MDN1 KIF11 1674/4885TAAR1 1422/4885PTGS1 2423/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.