SCHEMBL3875281

SCHEMBL3875281

CC(C)Oc1ccc(N)cc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
ALDH1A1 P00352 7/20 0.48
MAPT P10636 6/20 0.48
GAA P10253 5/20 0.48
KDM4E B2RXH2 5/20 0.48
CASP1 P29466 3/20 0.48
USP2 O75604 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HTT P42858 2/20 0.48
TP53 P04637 1/20 0.48
CASP7 P55210 1/20 0.48
ATM Q13315 1/20 0.48
CSNK2A1 P68400 2/20 0.42
TLR8 Q9NR97 1/20 0.41
LMNA P02545 2/20 0.40
CYP3A4 P08684 1/20 0.38
MCHR1 Q99705 1/20 0.37
THRB P10828 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.36

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
SCHEMBL3732045 0.85 ALDH1A1 (0.47) POLBALDH1A1MAPTGAAKDM4E
SCHEMBL7325807 0.84 ALDH1A1 (0.50) POLBALDH1A1MAPTGAAKDM4E
SCHEMBL129715 0.83 ALDH1A1 (0.46) POLBALDH1A1MAPTGAAKDM4E
SCHEMBL9503183 0.83 ALDH1A1 (0.46) POLBALDH1A1MAPTGAAKDM4E
Hydrochloric Acid SCHEMBL10607534 0.83 ALDH1A1 (0.53) POLBALDH1A1MAPTGAAKDM4E
SCHEMBL7519140 0.83 ALDH1A1 (0.44) POLBALDH1A1MAPTGAAKDM4E
Hydrochloric Acid SCHEMBL10397659 0.82 ALDH1A1 (0.49) POLBALDH1A1MAPTGAAKDM4E
Hydrochloric Acid SCHEMBL1426463 0.82 ALDH1A1 (0.49) POLBALDH1A1MAPTGAAKDM4E
Hydrochloric Acid SCHEMBL29836005 0.82 ALDH1A1 (0.49) POLBALDH1A1MAPTGAAKDM4E
Hydrochloric Acid SCHEMBL33975 0.82 ALDH1A1 (0.49) POLBALDH1A1MAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2950774-B1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE OREAL (FR) 2018-07-25 EP claimed
EP-1674075-B1 Hair colouring process comprising a cleaning step ORÉAL L (FR) 2016-07-20 EP claimed
US-20150366771-A1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE L'OREAL (FR) 2015-12-24 US claimed
US-7485155-B2 Process for washing colored keratinous fibers with a composition comprising at least one nonionic surfactant and method for protecting the color L'OREAL S.A. (FR) 2009-02-03 US claimed
US-20060156478-A1 Process for washing colored keratinous fibers with a composition comprising at least one nonionic surfactant and method for protecting the color L'OREAL S.A. (FR) 2006-07-20 US claimed
US-10383803-B2 Dye composition using at least one coupler of meta-phenylenediamine type substituted in position 4 in a medium comprising a fatty substance, processes and device L'OREAL (FR) 2019-08-20 US disclosed
US-10383803-B2 Dye composition using at least one coupler of meta-phenylenediamine type substituted in position 4 in a medium comprising a fatty substance, processes and device L'OREAL (FR) 2019-08-20 US disclosed
EP-2950774-B1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE OREAL (FR) 2018-07-25 EP disclosed
EP-2950774-B1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE OREAL (FR) 2018-07-25 EP disclosed
US-20160310383-A1 METHOD FOR DYEING KERATINOUS SUBSTANCES STARTING FROM COLOURED OLIGOMERS AND/OR POLYMERS RESULTING FROM META-PHENYLENEDIAMINES, COMPOSITION AND DYEING AGENT L'OREAL (FR) 2016-10-27 US disclosed
US-20160310383-A1 METHOD FOR DYEING KERATINOUS SUBSTANCES STARTING FROM COLOURED OLIGOMERS AND/OR POLYMERS RESULTING FROM META-PHENYLENEDIAMINES, COMPOSITION AND DYEING AGENT L'OREAL (FR) 2016-10-27 US disclosed
US-20150366771-A1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE L'OREAL (FR) 2015-12-24 US disclosed
US-20060156478-A1 Process for washing colored keratinous fibers with a composition comprising at least one nonionic surfactant and method for protecting the color L'OREAL S.A. (FR) 2006-07-20 US disclosed
EP-0328968-B1 PROCESS FOR THE PREPARATION OF 4-ACYLAMINO-2-AMINO ALKOXY BENZENES HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-12 EP disclosed
US-5047586-A Process for the preparation of 4-acylamino-2-aminoalkoxybenzenes HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-10 US disclosed
US-4225492-A Water-soluble disazo dyestuffs, prepared from unsymmetrical heterocyclic diamines CASSELLA AKTIENGESELLSCHAFT (DE) 1980-09-30 US disclosed
US-4144231-A Soluble trisazo dyestuffs containing a 2-phenyl-benzimidazolyl, -benzoxazolyl or -benzthiazolyl middle component CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-13 US disclosed
US-4144230-A Soluble trisazo dyestuffs containing a 2-phenyl-benzimidazolyl, -benzoxazolyl or -benzthiazolyl middle component CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-13 US disclosed
US-4143033-A WATER-SOLUBLE DISAZO DYESTUFFS CONTAINING A 2-PHENYL-BENZIMIDAZOLYL,-BENZOXAZOLYL OR-BENZTHIAZOLYL MIDDLE COMPONENT CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-06 US disclosed
US-4137228-A HIGH TINCTORIAL STRENGTH, COLORFASTNESS CASSELLA AKTIENGESELLSCHAFT (DE) 1979-01-30 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 (4 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-20160310383-A1 METHOD FOR DYEING KERATINOUS SUBSTANCES STARTING FROM COLOURED OLIGOMERS AND/OR POLYMERS RESULTING FROM META-PHENYLENEDIAMINES, COMPOSITION AND DYEING AGENT KRT18, VIM, SORD POLB 522/4885ALDH1A1 1145/4885MAPT 29/4885
US-10383803-B2 Dye composition using at least one coupler of meta-phenylenediamine type substituted in position 4 in a medium comprising a fatty substance, processes and device FABP4, KRT18, DSG1 POLB 579/4885ALDH1A1 317/4885MAPT 1508/4885
US-20060156478-A1 Process for washing colored keratinous fibers with a composition comprising at least one nonionic surfactant and method for protecting the color KRT18, DSG1, DSP POLB 538/4885ALDH1A1 2250/4885MAPT 998/4885
US-20150366771-A1 DYE COMPOSITION USING AT LEAST ONE COUPLER OF META-PHENYLENEDIAMINE TYPE SUBSTITUTED IN POSITION 4 IN A MEDIUM COMPRISING A FATTY SUBSTANCE, PROCESSES AND DEVICE FABP4, KRT18, DSG1 POLB 574/4885ALDH1A1 354/4885MAPT 1422/4885

“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.