SCHEMBL2028301

SCHEMBL2028301

CN(C)c1ccc(C=C2C(=O)CC(C)(C)CC2=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.65
▸ ALDH1A1 P00352 6/20 0.59
▸ CRHBP P24387 3/20 0.59
▸ CRHR2 Q13324 3/20 0.59
▸ METAP1 P53582 1/20 0.57
▸ KMT2A Q03164 5/20 0.54
▸ HPGD P15428 4/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ PKM P14618 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ MAPT P10636 7/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ PIM1 P11309 1/20 0.51
▸ PIM2 Q9P1W9 1/20 0.51
▸ PDGFRB P09619 3/20 0.49
▸ CYP1A2 P05177 3/20 0.49
▸ SNCA P37840 3/20 0.49
▸ MAPK1 P28482 2/20 0.49

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
SCHEMBL27735454 0.83 MAPT (0.64) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL2024634 0.79 ALDH1A1 (0.51) APPALDH1A1METAP1KMT2AHPGD
SCHEMBL5171393 0.79 MAPT (0.68) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL2025945 0.79 ALDH1A1 (0.51) APPALDH1A1KMT2AHPGDMEN1
SCHEMBL29711922 0.75 METAP1 (0.86) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL9196949 0.75 ALDH1A1 (1.00) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL4096609 0.72 METAP1 (1.00) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL7005334 0.72 ALDH1A1 (0.58) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL12865918 0.71 ALDH1A1 (0.91) APPALDH1A1CRHBPCRHR2METAP1
SCHEMBL4037782 0.70 METAP1 (0.76) APPALDH1A1CRHBPCRHR2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 — — EP claimed
US-7413579-B2 Method for dyeing fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-19 — — US claimed
US-7300472-B2 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-27 — — US claimed
US-20070000074-A1 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2007-01-04 — — US claimed
EP-1534227-B1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KGAA (DE) 2006-12-27 — — EP claimed
US-20060265818-A1 At least two oxidation dye precursors, at least one of which must be of the developer type or at least two oxo dye precursors, at least one of which must be a reactive carbonyl compound; hair dyes producing uniform and natural-looking, lightened color reflections HENKEL KOMMANDITGESELLSCHAFT AUF AKLLEN (HENKEL KGAA) (DE) 2006-11-30 — — US claimed
EP-1433469-B1 Composition for dyeing keratinous fibres HENKEL KGAA (DE) 2006-10-11 — — EP claimed
US-7105032-B2 Agents used for dyeing keratinous fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-09-12 — — US claimed
US-20050144740-A1 Agents used for dyeing keratinous fibers HENKEL AG & CO. KGAA (DE) 2005-07-07 — — US claimed
EP-1433469-A1 Composition for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 — — EP claimed
EP-1730049-B1 COSMETIC PORTION HENKEL AG & CO KGAA (DE) 2018-09-12 — — EP disclosed
EP-1900393-B1 Hydrogen peroxide activation with diones and imidazoles HENKEL AG & CO KGAA (DE) 2018-02-28 — — EP disclosed
EP-1978840-B1 AUXILIARY AGENT FOR STYLISHLY COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2016-07-06 — — EP disclosed
EP-2026754-B1 LIGHTENING AND/OR COLOURING AGENT COMPRISING CYCLIC UREA DERIVATIVES HENKEL AG & CO KGAA (DE) 2015-09-30 — — EP disclosed
EP-1871486-B1 OXIDATION DYES COMPRISING PERSULFATES AND/OR PEROXODISULFATES HENKEL AG & CO KGAA (DE) 2014-07-09 — — EP disclosed
EP-1433469-A1 Composition for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 — — EP disclosed
EP-1430874-A2 4-N, N-Bis-(monohydroxyalkyl)amino-3-nitrophenol derivatives in dyeing compositions for keratinic fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-23 — — EP disclosed
WO-2004031164-A1 HAIR DYES COMPRISING M-PHENYLENEDIAMINE DERIVATIVES AS COUPLING COMPONENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-04-15 — — WO disclosed
WO-2004022016-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-03-18 — — WO disclosed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 — — 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 (3 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-20050144740-A1 Agents used for dyeing keratinous fibers KRT18, TUBB3, DSG1 APP 2519/4885ALDH1A1 343/4885CRHBP 2752/4885
US-20060265818-A1 At least two oxidation dye precursors, at least one of which must be of the developer type or at least two oxo dye precursors, at least one of which must be a reactive carbonyl compound; hair dyes producing uniform and natural-looking, lightened color reflections KRT18, CUTA, PLOD2 APP 959/4885ALDH1A1 159/4885CRHBP 3139/4885
US-20070000074-A1 Agents for coloring fibers containing keratin KRT18, COL1A1, CYC1 APP 2312/4885ALDH1A1 780/4885CRHBP 1735/4885

“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.

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