SCHEMBL33918

SCHEMBL33918

Nc1cnn(Cc2ccc(Cl)cc2)c1N

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
POLB P06746 2/20 0.47
GAA P10253 1/20 0.47
GFER P55789 1/20 0.47
LMNA P02545 3/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
STAT3 P40763 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.41
NPBWR1 P48145 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL3254682 0.92 TSHR (0.55) TSHRPOLBGAAGFERLMNA
SCHEMBL4617765 0.91 TSHR (0.54) TSHRPOLBGAAGFERLMNA
Sulfuric Acid SCHEMBL2917846 0.91 TSHR (0.61) TSHRPOLBGAAGFERLMNA
Hydrochloric Acid SCHEMBL6755818 0.90 TSHR (0.53) TSHRPOLBGAAGFERLMNA
SCHEMBL6002740 0.87 TSHR (0.50) TSHRPOLBGAAGFERLMNA
SCHEMBL6004065 0.87 TSHR (0.50) TSHRPOLBGAALMNAMEN1
SCHEMBL145302 0.84 NPC1 (0.57) TSHRGAALMNAMEN1MAPT
SCHEMBL144813 0.83 TSHR (0.69) TSHRPOLBGAAMAPTSMN1; SMN2
SCHEMBL4802151 0.82 TSHR (0.50) TSHRPOLBLMNAMEN1MAPT
Hydrochloric Acid SCHEMBL4872292 0.80 KDM4E (0.56) TSHRGAALMNAALDH1A1NPC1

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

Appears in 4543 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025043531-A1 COLORANT COMPOSITION FOR DYEING KERATIN FIBERS AND KIT COMPRISING THE SAME L'OREAL (FR) 2025-03-06 WO 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
US-11142498-B2 Keratin dyeing compounds, compositions containing them, and method and use thereof WELLA OPERATIONS US, LLC (US) 2021-10-12 US 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-3142638-B1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AN OXIDATION BASE AND A PARTICULAR HETEROARYL COUPLER OREAL (FR) 2020-08-12 EP claimed
US-20200247749-A1 KERATIN DYEING COMPOUNDS, COMPOSITIONS CONTAINING THEM, AND METHOD AND USE THEREOF WELLA OPERATIONS US, LLC 2020-08-06 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
WO-2019074736-A1 KERATIN DYEING COMPOUNDS, COMPOSITIONS CONTAINING THEM, AND METHOD AND USE THEREOF NOXELL CORPORATION (US) 2019-04-18 WO claimed
EP-3464247-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES L'Oréal (FR) 2019-04-10 EP claimed
US-9993409-B2 Composition for dyeing keratin fibres, comprising an oxidation base and a particular heteroaryl coupler L'OREAL (FR) 2018-06-12 US claimed
US-5785717-A Composition for the oxidation dyeing of keratin fibers, comprising a diaminopyrazole derivative and a heterocyclic coupler, and dyeing process L'OREAL (FR) 1998-07-28 US claimed
US-5718731-A Oxidation hair dye composition based on 4,5-diaminopyrazole and m-phenylenediamine derivatives WELLA AKTIENGESELLSCHAFT (DE) 1998-02-17 US claimed
EP-0790818-A1 KERATIN FIBRE OXIDATION DYEING COMPOSITION AND DYEING METHOD USING SAME L'OREAL (FR) 1997-08-27 EP claimed
EP-0728464-B1 Composition for dyeing keratinous fibers comprising a diaminopyrazole derivative and a heterocyclic coupleur and dyeing process OREAL (FR) 1997-07-30 EP claimed
EP-0692245-B1 Oxidation hair dye containing 4,5-diaminopyrazole derivatives and m-phenylendiamine derivatives WELLA AG (DE) 1997-05-02 EP claimed
WO-1997015271-A1 METHOD FOR OXIDATION DYEING KERATIN FIBRES AND COMPOSITION THEREFOR L'OREAL (FR) 1997-05-01 WO claimed
WO-1997011673-A1 KERATIN FIBRE OXIDATION DYEING COMPOSITION AND DYEING METHOD USING SAME L'OREAL (FR) 1997-04-03 WO claimed
EP-0728464-A1 Composition for dyeing keratinous fibers comprising a diaminopyrazole derivative and a heterocyclic coupleur and dyeing process L'OREAL (FR) 1996-08-28 EP claimed
US-5534267-A Composition for the oxidative dyeing of hair containing 4,5-diaminopyrazole derivatives as well as new 4,5-diaminopyrazole derivatives and process for their synthesis WELLA AKTIENGESELLSCHAFT (DE) 1996-07-09 US claimed
EP-0692245-A1 Oxidation hair dye containing 4,5-diaminopyrazole derivatives and m-phenylendiamine derivatives Wella Aktiengesellschaft (DE) 1996-01-17 EP claimed