SCHEMBL17477705

SCHEMBL17477705

CC(O)Oc1nn2ccccc2c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 6/20 0.40
PDE4B Q07343 6/20 0.40
PDE3A Q14432 4/20 0.40
MIF P14174 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
PDE4A P27815 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
CYP2C19 P33261 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PDE3B Q13370 1/20 0.40

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
SCHEMBL5145184 0.88 PDE5A (0.39) PDE5APDE4BPDE3AMIFALDH1A1
Hydrochloric Acid SCHEMBL1842793 0.86 PDE5A (0.38) PDE5APDE4BPDE3AMIFALDH1A1
SCHEMBL29003662 0.82 EGFR (0.35) PDE5APDE4BPDE3AMIFALDH1A1
SCHEMBL1841814 0.80 PIK3CA (0.37) PDE5APDE4BPDE3AMIFALDH1A1
SCHEMBL33951 0.79 EGFR (0.41) PDE5APDE4BPDE3AMIFALDH1A1
Hydrochloric Acid SCHEMBL7822879 0.78 EGFR (0.41) PDE5APDE4BPDE3AMIFALDH1A1
Hydrochloric Acid SCHEMBL1151697 0.78 EGFR (0.41) PDE5APDE4BPDE3AMIFALDH1A1
SCHEMBL29003664 0.77 EGFR (0.35) PDE5APDE4BPDE3AMIFALDH1A1
Hydrochloric Acid SCHEMBL9137257 0.76 PDE4B (0.50) PDE5APDE4BPDE3AMIFALDH1A1
Hydrochloric Acid SCHEMBL8977958 0.76 PDE4B (0.50) PDE5APDE4BPDE3AMIFALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240000684-A1 DYEING COMPOSITION BASED ON 2-GAMMA-HYDROXYPROPYL-PARA-PHENYLENEDIAMINE AND ON A PHOSPHORIC SURFACTANT L'OREAL (FR) 2024-01-04 US claimed
US-20230047506-A1 COATED COLOURING SOLID PARTICLES COMPRISING AT LEAST ONE DIRECT DYE AND/OR ONE OXIDATION DYE PRECURSOR L'OREAL (FR) 2023-02-16 US claimed
US-20230048382-A1 PROCESS FOR PREPARING A DYE COMPOSITION BY MIXING SOLID PARTICLES AND AN OXIDIZING COMPOSITION AND AN ALKALINE COMPOSITION L'OREAL (FR) 2023-02-16 US claimed
US-11555017-B2 Oxidation base derived from 1-hexyl-4,5-diaminopyrazole, composition containing same and use thereof in oxidation dyeing of keratin fibres L'OREAL (FR) 2023-01-17 US claimed
CN-114599332-A Process for preparing a dye composition by mixing solid particles and an oxidizing composition with a basic composition 欧莱雅 2022-06-07 CN claimed
US-20200392088-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2020-12-17 US claimed
EP-3464247-B1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES OREAL (FR) 2020-03-11 EP claimed
EP-4448118-A1 PROCESS FOR LIGHTENING OR FOR SIMULTANEOUSLY BLEACHING AND DYEING KERATIN FIBRES L'OREAL (FR) 2024-10-23 EP disclosed
EP-4448119-A1 COMPOSITION FOR LIGHTENING KERATIN FIBRES AND PROCESS FOR LIGHTENING KERATIN FIBRES USING THIS COMPOSITION L'OREAL (FR) 2024-10-23 EP disclosed
EP-4440705-A1 COMPOSITIONS, METHODS, AND KITS FOR ALTERING THE COLOR OF HAIR L'OREAL (FR) 2024-10-09 EP disclosed
US-12036299-B2 Compositions containing direct dyes for imparting color and tone to the hair L'OREAL (FR) 2024-07-16 US disclosed
EP-4395734-A1 COMPOSITIONS, KITS, AND METHODS FOR ALTERING THE COLOR OF HAIR L'OREAL (FR) 2024-07-10 EP disclosed
CN-118043027-A Process for dyeing and/or lightening keratin fibres 莱雅公司 2024-05-14 CN disclosed
US-20160367447-A1 PACKAGING ARTICLE COMPRISING AN ENVELOPE AND AN ANHYDROUS DYE COMPOSITION COMPRISING AN OXIDATION DYE, USE OF THE SAME AND PROCESS FOR DYEING KERATIN FIBRES L'OREAL (FR) 2016-12-22 US disclosed
WO-2016198643-A1 MULTI-STEP HAIR DYEING PROCESS USING AT LEAST ONE TITANIUM SALT AND A SYNTHETIC DIRECT DYE L'OREAL (FR) 2016-12-15 WO disclosed
US-20160175233-A1 HAIR COLORING COMPOSITIONS COMPRISING LATEX POLYMERS L'OREAL (FR) 2016-06-23 US disclosed
WO-2016091817-A1 HAIR DYEING PROCESS USING AT LEAST ONE DYE, AN ORGANIC TITANIUM SALT, AND A NON-CELLULOSIC-BASED POLYSACCHARIDE L'OREAL (FR) 2016-06-16 WO disclosed
WO-2016091816-A1 HAIR DYEING PROCESS USING AT LEAST ONE DYE, A TITANIUM SALT AND A CATIONIC HYDROPHOBIC CELLULOSIC POLYSACCHARIDE L'OREAL (FR) 2016-06-16 WO disclosed
WO-2016091721-A1 HAIR DYEING PROCESS USING AT LEAST ONE DYE, A TITANIUM SALT AND AN ANIONIC THICKENING POLYMER L'OREAL (FR) 2016-06-16 WO disclosed
WO-2016016441-A1 COMPOSITION COMPRISING AN AMPS® COPOLYMER AND AN OXIDATION DYE PRECURSOR AND/OR A DIRECT DYE L'OREAL (FR) 2016-02-04 WO 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 (8 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-20160367447-A1 PACKAGING ARTICLE COMPRISING AN ENVELOPE AND AN ANHYDROUS DYE COMPOSITION COMPRISING AN OXIDATION DYE, USE OF THE SAME AND PROCESS FOR DYEING KERATIN FIBRES KRT18, LPO, PLOD2 PDE5A 2905/4885PDE4B 4236/4885PDE3A 3762/4885
US-20230048382-A1 PROCESS FOR PREPARING A DYE COMPOSITION BY MIXING SOLID PARTICLES AND AN OXIDIZING COMPOSITION AND AN ALKALINE COMPOSITION KRT18, OAT, ARG2 PDE5A 697/4885PDE4B 2671/4885PDE3A 1501/4885
US-12036299-B2 Compositions containing direct dyes for imparting color and tone to the hair PHOSPHO1, TYR, AADAT PDE5A 603/4885PDE4B 789/4885PDE3A 714/4885
US-20160175233-A1 HAIR COLORING COMPOSITIONS COMPRISING LATEX POLYMERS KRT18, PLOD3, PLOD1 PDE5A 2830/4885PDE4B 4318/4885PDE3A 3098/4885
US-20240000684-A1 DYEING COMPOSITION BASED ON 2-GAMMA-HYDROXYPROPYL-PARA-PHENYLENEDIAMINE AND ON A PHOSPHORIC SURFACTANT OR10J3, HRH4, HRH3 PDE5A 4635/4885PDE4B 4209/4885PDE3A 4712/4885
US-20200392088-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES KRT18, ALK, AOC1 PDE5A 2169/4885PDE4B 2733/4885PDE3A 3080/4885
US-20230047506-A1 COATED COLOURING SOLID PARTICLES COMPRISING AT LEAST ONE DIRECT DYE AND/OR ONE OXIDATION DYE PRECURSOR KRT18, CYBA, IK PDE5A 3063/4885PDE4B 4615/4885PDE3A 4015/4885
US-11555017-B2 Oxidation base derived from 1-hexyl-4,5-diaminopyrazole, composition containing same and use thereof in oxidation dyeing of keratin fibres KRT18, ALK, AOC1 PDE5A 1895/4885PDE4B 2422/4885PDE3A 2688/4885

“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.