SCHEMBL4245018

SCHEMBL4245018

CCOc1cc(C)c(N)cc1N.COc1cc(C)c(N)cc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.51
POLB P06746 3/20 0.51
GFER P55789 1/20 0.51
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 5/20 0.47
HSD17B10 Q99714 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPK1 P28482 2/20 0.47
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
CYP3A4 P08684 1/20 0.41
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 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
SCHEMBL29358090 0.92 MAPT (0.53) GAAPOLBGFERKDM4EMAPT
SCHEMBL148285 0.92 MAPT (0.53) GAAPOLBGFERKDM4EMAPT
Hydrochloric Acid SCHEMBL10362702 0.90 MAPT (0.52) GAAPOLBGFERKDM4EMAPT
Hydrochloric Acid SCHEMBL29358790 0.90 MAPT (0.52) GAAPOLBGFERKDM4EMAPT
Hydrochloric Acid SCHEMBL3341943 0.90 MAPT (0.52) GAAPOLBGFERKDM4EMAPT
SCHEMBL5367514 0.89 POLB (0.43) GAAPOLBGFERKDM4EMAPT
SCHEMBL8022335 0.86 ALDH1A1 (0.55) GAAPOLBKDM4EMAPTALDH1A1
SCHEMBL11581139 0.86 ALDH1A1 (0.55) GAAPOLBKDM4EMAPTALDH1A1
SCHEMBL453847 0.86 L3MBTL1 (0.60) GAAPOLBGFERMAPTALDH1A1
SCHEMBL29540409 0.86 L3MBTL1 (0.60) GAAPOLBGFERMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10064471-B2 Air oxidation hair dye application system and method for coloring hair using the same COMBE INCORPORATED (US) 2018-09-04 US disclosed
US-9901529-B2 Hair color composition ALFA PARF GROUP S.P.A. (IT) 2018-02-27 US disclosed
US-20170105921-A1 HAIR COLOR COMPOSITION ALFA PARF GROUP S.P.A. (IT) 2017-04-20 US disclosed
EP-3156041-A1 HAIR COLOR COMPOSITION Alfa Parf Group S.p.a. (IT) 2017-04-19 EP disclosed
EP-2211657-B1 AIR OXIDATION HAIR DYE APPLICATION SYSTEM AND METHOD FOR COLORING HAIR USING THE SAME COMBE INTERNAT LTD (US) 2014-04-30 EP disclosed
US-20090114237-A1 AIR OXIDATION HAIR DYE APPLICATION SYSTEM AND METHOD FOR COLORING HAIR USING THE SAME COMBE INCORPORATED (US) 2009-05-07 US disclosed
US-7465323-B2 High carbonate oxidative dye compositions CONOPCO, INC. (US) 2008-12-16 US disclosed
US-20070174976-A1 High carbonate oxidative dye compositions CONOPCO, INC., D/B/A UNILEVER 2007-08-02 US disclosed
US-20060137111-A1 One step hair coloring using salts UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2006-06-29 US disclosed
US-20040255399-A1 Method and compositions for coloring hair with taurate copolymers UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-12-23 US disclosed
US-20040098816-A1 Method and kit for the gradual permanent coloring of hair UNILEVER HOME & PERSONAL CARE USA DIVISION OF CONOPCO, INC. 2004-05-27 US 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-20040255399-A1 Method and compositions for coloring hair with taurate copolymers ADH1A, GRHPR, ADH1C GAA 3402/4885POLB 213/4885GFER 5/4885

“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.