SCHEMBL691644

SCHEMBL691644

CNc1ccc(NOC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
ALDH1A1 P00352 3/20 0.44
RECQL P46063 3/20 0.44
HSD17B10 Q99714 2/20 0.44
THRB P10828 2/20 0.44
HPGD P15428 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
HIF1A Q16665 1/20 0.44
APP P05067 9/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
KIF11 P52732 1/20 0.38
MAPT P10636 2/20 0.37

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
SCHEMBL29910198 0.88 NPC1 (0.41) RECQLTHRBHPGDTP53ALOX15
SCHEMBL11178475 0.87 TSHR (0.67) TSHRALDH1A1HSD17B10CYP3A4ALOX15
SCHEMBL14590749 0.81 TSHR (0.43) TSHRALDH1A1RECQLHSD17B10THRB
SCHEMBL11146268 0.80 SMN1; SMN2 (0.44) RECQLTHRBTP53KIF11MAPT
SCHEMBL153943 0.78 TSHR (0.67) TSHRALDH1A1RECQLHSD17B10THRB
SCHEMBL13724343 0.78 TDP1 (0.46) ALDH1A1HPGDMAPTNPC1RAB9A
SCHEMBL14520272 0.78 ALDH1A1 (0.46) TSHRALDH1A1RECQLHSD17B10THRB
SCHEMBL12200621 0.76 NPC1 (0.33) RECQLTHRBMAPTNPC1RAB9A
SCHEMBL11421289 0.76 KCNH3 (0.50) ALDH1A1MAPTNPC1RAB9AKDM4E
SCHEMBL1189234 0.76 HPGD (0.48) TSHRTHRBHPGDCYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230310296-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations HENKEL AG & CO. KGAA (DE) 2023-10-05 US claimed
EP-4237405-A1 2-METHOXYMETHYL-P-PHENYLENEDIAMINE IN COSMETIC GRADE QUALITY Wella Germany GmbH (DE) 2023-09-06 EP claimed
US-11517514-B2 Resorcinol-free hair colouring compositions BEAUTY & BUSINESS S.P.A. (IT) 2022-12-06 US claimed
EP-4066812-A1 RESORCINOL-FREE HAIR COLOURING COMPOSITIONS Beauty & Business S.p.A. (IT) 2022-10-05 EP claimed
US-20220304908-A1 RESORCINOL-FREE HAIR COLOURING COMPOSITIONS BEAUTY & BUSINESS S.P.A. (IT) 2022-09-29 US claimed
WO-2022090235-A1 2-METHOXYMETHYL-P-PHENYLENEDIAMINE IN COSMETIC GRADE QUALITY WELLA GERMANY GMBH (DE) 2022-05-05 WO claimed
US-11285091-B2 M-aminophenol-free hair-colouring compositions BEAUTY & BUSINESS S.P.A. (IT) 2022-03-29 US claimed
US-20210177717-A1 M-AMINOPHENOL-FREE HAIR-COLOURING COMPOSITIONS BEAUTY & BUSINESS S.P.A. (IT) 2021-06-17 US claimed
EP-2103299-B1 Oxidizing hair colourant compositions PROCTER & GAMBLE (US) 2013-02-27 EP claimed
EP-2421613-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP claimed
US-7988740-B2 Keratin dyeing compositions comprising a radical scavenger and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-08-02 US claimed
US-7985266-B2 Keratin dyeing compositions comprising a radical scavenger and a chelant and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-07-26 US claimed
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof NOXELL CORPORATION 2011-02-17 US claimed
US-20110035886-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and a Chelant and Use Thereof NOXELL CORPORATION 2011-02-17 US claimed
WO-2010123866-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO claimed
WO-2010123863-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO claimed
US-7597720-B2 Oxidizing hair colourant compositions THE PROCTER & GAMBLE COMPANY (US) 2009-10-06 US claimed
EP-2103299-A2 Oxidizing hair colourant compositions The Procter and Gamble Company (US) 2009-09-23 EP claimed
US-20090119852-A1 Oxidizing Hair Colourant Compositions WELLA OPERATIONS US, LLC 2009-05-14 US claimed
WO-2009060334-A2 OXIDIZING HAIR COLOURANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2009-05-14 WO 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 (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-20090119852-A1 Oxidizing Hair Colourant Compositions TET1, TET2, TET3 TSHR 2249/4885ALDH1A1 533/4885RECQL 3341/4885
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof KRT18, LPO, CYB5R3 TSHR 4803/4885ALDH1A1 326/4885RECQL 2487/4885
US-20110035886-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and a Chelant and Use Thereof KRT18, LPO, KRTCAP2 TSHR 4386/4885ALDH1A1 354/4885RECQL 3861/4885
US-20230310296-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations KRT18, ALDH5A1, ALDH2 TSHR 4836/4885ALDH1A1 40/4885RECQL 4263/4885

“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.