SCHEMBL128209

SCHEMBL128209

Cc1cc(N(C)C)n2nc(C)c(N)c2n1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.45
CRHR1 P34998 16/20 0.42
HTR6 P50406 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39

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
Hydrochloric Acid SCHEMBL7827431 0.98 ENPP1 (0.44) ENPP1CRHR1HTR6KDM4EMEN1
SCHEMBL126427 0.80 KDM4E (0.58) HTR6KDM4EMEN1ALDH1A1MAPT
SCHEMBL5716488 0.80 ENPP1 (0.45) ENPP1CRHR1HTR6
SCHEMBL38666647 0.79 PIK3CG (0.50) HTR6KDM4EMEN1ALDH1A1MAPT
SCHEMBL7465690 0.75 MEN1 (0.44) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL7815444 0.70 HTR6 (0.41) ENPP1CRHR1HTR6KDM4EMEN1
SCHEMBL7827118 0.68 ENPP1 (0.50) ENPP1HTR6KDM4EALDH1A1MAPT
SCHEMBL128480 0.68 PIK3CG (0.42) HTR6KDM4EMEN1ALDH1A1MAPT
SCHEMBL7465074 0.67 HTR6 (0.40) HTR6KDM4EMEN1ALDH1A1MAPT
SCHEMBL7459734 0.64 ALDH1A1 (0.35) KDM4EMEN1ALDH1A1MAPTKMT2A

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 1381 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1443890-B1 OXIDATION COLOURING AGENT BASED ON BICYCLIC DEVELOPER COMPONENTS HENKEL AG & CO KGAA (DE) 2010-01-13 EP claimed
EP-1352636-B1 Oxidation dyeing composition for keratin fibers comprising 2-chloro-6-methyl-3-aminophenol and an oxidation base, and dyeing method OREAL (FR) 2009-04-22 EP claimed
EP-1405627-B1 Antipenetrating hair pretreatment composition based on polyethelenoxide polymer(s) and process using said composition for limiting skin penetration by colourants OREAL (FR) 2008-04-30 EP claimed
WO-2007071688-A1 COMPOSITION FOR DYEING KERATIN FIBRES WITH A TETRAAZAPENTAMETHINE CATIONIC DIRECT DYE, A PARTICULAR OXIDATION BASE AND A COUPLER L'ORÉAL (FR) 2007-06-28 WO claimed
WO-2007071686-A1 COMPOSITION FOR DYEING KERATIN FIBRES WITH A TETRAAZAPENTAMETHINE CATIONIC DIRECT DYE, AN OXIDATION BASE AND A PARTICULAR COUPLER L'ORÉAL (FR) 2007-06-28 WO claimed
US-7189267-B2 Oxyethylenated based hair pre-treatment anti-penetration composition and method using such a composition for limiting the penetration of dyes into the skin L'OREAL (FR) 2007-03-13 US claimed
US-7077871-B2 Coloring composition for keratin fibres comprising a system limiting the transcutaneous passage of an oxidation dye L'OREAL (FR) 2006-07-18 US claimed
EP-1210931-B1 Keratinic fibres dyeing composition OREAL (FR) 2006-04-05 EP claimed
EP-1299072-B1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES COMPRISING AN AMPHOTERIC POLYMER WITH FATTY CHAIN OREAL (FR) 2005-11-16 EP claimed
US-20040231071-A1 Oxyethylenated based hair pre-treatent anti-penetration composition and method using such a composition for limiting the penetration of dyes into the skin L'OREAL (FR) 2004-11-25 US claimed
US-6342078-B1 OXIDATION COLOR DYES FOR HAIR WITH METAPHENYLENEDIAMINE COUPLERS L'OREAL, S. A. (FR) 2002-01-29 US claimed
US-6312479-B1 OXIDATION BASE; COUPLER CHOSEN FROM 2-AMINO-3-HYDROXYPYRIDINES AND ACID-ADDITION SALTS THEREOF; A 2-ELECTRON OXIDOREDUCTASE; AND A DONOR FOR SAID ENZYME. L'OREAL S.A. (FR) 2001-11-06 US claimed
US-20010034914-A1 Compositions for the oxidation dyeing of keratinous fibers comprising at least one coupler, and dyeing methods L'OREAL S.A. (FR) 2001-11-01 US claimed
US-20010032368-A1 Dye compositions comprising at least one nonionic compound and uses thereof L'OREAL S.A. (FR) 2001-10-25 US claimed
US-6306181-B1 FOR DYEING HUMAN HAIR L'OREAL (FR) 2001-10-23 US claimed
US-6277156-B1 OXIDATION BASE ARE PARAPHENYLENEDIAMINES, DOUBLE BASES; PYRAZOLO(1,5-A)PYRIMIDINES ORTHO-AMINOPHENOLS; DIAMINOPYRIDINES L'ORéAL S.A. (FR) 2001-08-21 US claimed
US-6241784-B1 COSMETICS OR SKIN COMPOSITION FOR TREATING FIBERS L'OREAL S.A. (FR) 2001-06-05 US claimed
US-6228129-B1 OXIDATION BASE, CATIONIC DIRECT DYE AND AN ENZYME OF 2-ELECTRON OXIDOREDUCTASES IN THE PRESENCE OF A DONOR FOR THE ENZYME L'OREAL S.A. (FR) 2001-05-08 US claimed
US-6152967-A COMPOSITION FOR HAIR DYEING COMPRISING AT LEAST ONE OXIDATION BASE AND BILIRUBIN OXIDASE L'OREAL (FR) 2000-11-28 US claimed
US-6090159-A READY-TO-USE OXIDATION DYEING COMPOSITION COMPRISING AN OXIDATION BASE, SARCOSINE OXIDASE AS OXIDIZER, AND AT LEAST ONE DONOR FOR THE ENZYME; STRONGER COLORATION, NO BLEACHING L'OREAL (FR) 2000-07-18 US claimed

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

For each of this compound's patents that has machine-readable text (3 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-20010034914-A1 Compositions for the oxidation dyeing of keratinous fibers comprising at least one coupler, and dyeing methods KRT18, FH, FGB ENPP1 4275/4885CRHR1 2033/4885HTR6 2997/4885
US-20040231071-A1 Oxyethylenated based hair pre-treatent anti-penetration composition and method using such a composition for limiting the penetration of dyes into the skin KRT18, CUTA, COL14A1 ENPP1 2128/4885CRHR1 4137/4885HTR6 1605/4885
US-20010032368-A1 Dye compositions comprising at least one nonionic compound and uses thereof KRT18, AKR1B10, NDUFA10 ENPP1 4798/4885CRHR1 2499/4885HTR6 2883/4885

“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.