SCHEMBL454948

SCHEMBL454948

Nc1ccc(NCc2ccoc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.53
FYN P06241 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PIM1 P11309 1/20 0.37
DYRK1A Q13627 1/20 0.37
DYRK2 Q92630 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
MCHR1 Q99705 2/20 0.36
PDE10A Q9Y233 1/20 0.36
HTT P42858 2/20 0.35
ALOX5 P09917 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
APP P05067 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
TPH1 P17752 1/20 0.34

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
Hydrochloric Acid SCHEMBL6298681 0.98 HPGD (0.51) HPGDFYNMAOAMAOBPIM1
SCHEMBL8617029 0.81 HPGD (0.65) HPGDFYNMAOBHTTUSP2
SCHEMBL5693046 0.80 HPGD (0.68) HPGDFYNMCHR1PDE10AALDH1A1
Hydrochloric Acid SCHEMBL5850498 0.78 HPGD (0.66) HPGDFYNMAOAMAOBMCHR1
SCHEMBL455536 0.78 MEN1 (0.50) HPGDMAOAMAOBHTTUSP2
SCHEMBL3422016 0.78 MEN1 (0.50) HPGDMAOAMAOBHTTUSP2
SCHEMBL5154356 0.78 MEN1 (0.50) HPGDMAOAMAOBHTTUSP2
SCHEMBL31744631 0.77 MAPT (0.57) HPGDHTTALDH1A1CA12CA1
SCHEMBL6297594 0.77 HPGD (0.52) HPGDFYNPIM1DYRK1ADYRK2
Hydrochloric Acid SCHEMBL6304434 0.76 HPGD (0.51) HPGDFYNPIM1DYRK1ADYRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1752192-B1 Oxidizing hair coloring agents containing m-Aminophenol derivatives PROCTER & GAMBLE (US) 2010-02-03 EP claimed
US-6887281-B2 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds WELLA AKTIENGESELLSCHAFT (DE) 2005-05-03 US claimed
US-6849097-B2 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents WELLA AKTIENGESELLSCHAFT (DE) 2005-02-01 US claimed
US-20050015898-A1 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2005-01-27 US claimed
EP-1313724-B1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AG (DE) 2004-04-28 EP claimed
EP-1313724-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS Wella Aktiengesellschaft (DE) 2003-05-28 EP claimed
US-20030070240-A1 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2003-04-17 US claimed
WO-2002018365-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AKTIENGESELLSCHAFT (DE) 2002-03-07 WO claimed
US-12133906-B2 Delivery particle THE PROCTER & GAMBLE COMPANY (US) 2024-11-05 US disclosed
US-20220409497-A1 DELIVERY PARTICLE PROCTER & GAMBLE (US) 2022-12-29 US disclosed
EP-3733827-A1 DELIVERY PARTICLES The Procter & Gamble Company (US) 2020-11-04 EP disclosed
EP-2563508-B1 DELIVERY PARTICLE PROCTER & GAMBLE (US) 2019-07-10 EP disclosed
EP-1642563-B1 Method of rapid hair dyeing NOXELL CORP (US) 2019-06-26 EP disclosed
US-20190142714-A1 DELIVERY PARTICLE PROCTER & GAMBLE (US) 2019-05-16 US disclosed
EP-1484048-A1 Hair colouring compositions The Procter & Gamble Company (US) 2004-12-08 EP disclosed
US-20040237218-A1 Hair colouring compositions WELLA OPERATIONS US, LLC 2004-12-02 US disclosed
EP-1313724-B1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AG (DE) 2004-04-28 EP disclosed
EP-1313724-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS Wella Aktiengesellschaft (DE) 2003-05-28 EP disclosed
US-20030070240-A1 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2003-04-17 US disclosed
WO-2002018365-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AKTIENGESELLSCHAFT (DE) 2002-03-07 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 (6 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-20220409497-A1 DELIVERY PARTICLE LIPA, CHMP4B, SLC46A1 HPGD 447/4885FYN 3601/4885MAOA 259/4885
US-20030070240-A1 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents PNMT, PAH, CYP2E1 HPGD 296/4885FYN 1342/4885MAOA 30/4885
US-12133906-B2 Delivery particle LIPA, CHMP4B, SLC46A1 HPGD 447/4885FYN 3601/4885MAOA 259/4885
US-20190142714-A1 DELIVERY PARTICLE LIPA, CHMP4B, SLC46A1 HPGD 447/4885FYN 3601/4885MAOA 259/4885
US-20040237218-A1 Hair colouring compositions COXFA4L2, CYBA, MT-CO3 HPGD 1232/4885FYN 1462/4885MAOA 160/4885
US-20050015898-A1 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds TYR, PNMT, DDT HPGD 284/4885FYN 834/4885MAOA 84/4885

“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.