SCHEMBL564987

SCHEMBL564987

Nc1ccc(NCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.64
CA1 P00915 2/20 0.59
CA2 P00918 2/20 0.59
CA12 O43570 1/20 0.59
CA9 Q16790 1/20 0.59
MAOA P21397 3/20 0.55
MAOB P27338 3/20 0.55
ALDH1A1 P00352 3/20 0.55
CYP1A2 P05177 3/20 0.55
CYP2D6 P10635 1/20 0.55
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 0.53
PTPN1 P18031 1/20 0.53
PTPRZ1 P23471 1/20 0.53
MAPT P10636 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
ALOX12 P18054 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL31396238 0.92 HTT (0.56) HTTCA1CA2CA12CA9
SCHEMBL333550 0.91 CYP1A2 (0.58) HTTCA1CA2CA12CA9
SCHEMBL22669878 0.89 HTT (0.57) HTTCA1CA2CA12CA9
SCHEMBL3422016 0.89 MEN1 (0.50) HTTCA1CA2CA12CA9
SCHEMBL5154356 0.89 MEN1 (0.50) HTTCA1CA2CA12CA9
SCHEMBL455536 0.89 MEN1 (0.50) HTTCA1CA2CA12CA9
SCHEMBL1924100 0.89 HTT (0.78) HTTCA1CA2CA12CA9
SCHEMBL11936095 0.88 FFAR1 (0.63) HTTCA1CA2CA12CA9
Hydrochloric Acid SCHEMBL2985269 0.86 MAOA (0.48) HTTCA1CA2CA12CA9
Hydrochloric Acid SCHEMBL4949253 0.86 MAOA (0.48) HTTCA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12227612-B2 Ultrafast cyclic ether-amine photopolyaddition and uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2025-02-18 US claimed
EP-3856819-B1 ULTRAFAST CYCLIC ETHER-AMINE PHOTOPOLYADDITION AND USES THEREOF UNIV HAUTE ALSACE (FR) 2024-07-03 EP claimed
EP-3894475-B1 ASSEMBLY COMPONENTS COMPRISING CURABLE COMPOSITIONS CONTAINING ACETOACETYLATED RESINS EASTMAN CHEM CO (US) 2024-06-19 EP claimed
CN-112867748-B Ultra-fast cyclic ether-amine photopolymerization and use thereof 上阿尔萨斯大学 2024-03-08 CN claimed
CN-111971119-B Heterogeneous catalyst for carbamate synthesis 科思创知识产权两合公司 2023-12-08 CN claimed
US-11406964-B2 Heterogeneous catalysts for the synthesis of carbamates COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-08-09 US claimed
CN-110650944-B Silica-based zinc catalysts, their preparation and use in the alkoxycarbonylation of amines 科思创德国股份有限公司 2022-07-19 CN claimed
US-20210363286-A1 Ultrafast Cyclic Ether-Amine Photopolyaddition And Uses Thereof UNIVERSITÉ DE HAUTE-ALSACE (FR) 2021-11-25 US claimed
EP-3856819-A1 ULTRAFAST CYCLIC ETHER-AMINE PHOTOPOLYADDITION AND USES THEREOF Université de Haute Alsace (FR) 2021-08-04 EP claimed
EP-3625210-B1 SILICA-BASED ZINC CATALYSTS. THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2021-06-23 EP claimed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US claimed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP claimed
US-20070022546-A1 3-Amino-2-aminomethylphenol derivatives and colorants comprising these compounds PROCTER & GAMBLE COMPANY, THE 2007-02-01 US claimed
US-20060287555-A1 Process for the preparation of polyamines of the diphenylmethane series at a low degree of protonation COVESTRO DEUTSCHLAND AG (DE) 2006-12-21 US claimed
WO-2006086374-A2 3-AMINO-2-AMINOMETHYLPHENOL DERIVATIVES AND COLORANTS COMPRISING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2006-08-17 WO claimed
EP-1616890-A1 Method for producing of polyamines of the diphenylmethane series with low degree of protonation Bayer MaterialScience AG (DE) 2006-01-18 EP claimed
EP-1226107-B1 N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES CONTAINING COLOURING AGENTS FOR KERATIN FIBRES AND NOVEL N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES WELLA AG (DE) 2005-10-05 EP claimed
US-6689174-B2 FOR OXIDATIVELY DYEING HUMAN HAIR WELLA AKTIENGESELLSCHAFT (DE) 2004-02-10 US claimed
US-20020166181-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and novel n-benzyl-p-phenylenediamine-derivatives CHASSOT LAURENT (CH) 2002-11-14 US claimed
EP-0173932-A2 Hair dyeing composition Henkel Kommanditgesellschaft auf Aktien (DE) 1986-03-12 EP 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 (5 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-20070022546-A1 3-Amino-2-aminomethylphenol derivatives and colorants comprising these compounds KRT18, COL2A1, COL1A1 HTT 4112/4885CA1 3677/4885CA2 1507/4885
US-11406964-B2 Heterogeneous catalysts for the synthesis of carbamates SCO2, CDYL, PYM1 HTT 2509/4885CA1 284/4885CA2 33/4885
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene TACR1, KRT18, AKR1C4 HTT 2636/4885CA1 663/4885CA2 815/4885
US-20060287555-A1 Process for the preparation of polyamines of the diphenylmethane series at a low degree of protonation SRM, PNMT, DNMT1 HTT 1641/4885CA1 976/4885CA2 1798/4885
US-20020166181-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and novel n-benzyl-p-phenylenediamine-derivatives KRT18, KPNB1, VIM HTT 3842/4885CA1 2791/4885CA2 2166/4885

“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.