SCHEMBL111871

SCHEMBL111871

CCCN1CCc2cc(O)c(O)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ SMAD3 P84022 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MAOA P21397 1/20 0.41
▸ DRD2 P14416 2/20 0.39
▸ DRD4 P21917 2/20 0.39
▸ DRD1 P21728 1/20 0.39
▸ DRD5 P21918 1/20 0.39
▸ USP2 O75604 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
SCHEMBL29915622 1.00 MEN1 (0.42) MEN1ALDH1A1KMT2AKDM4ELMNA
SCHEMBL5179994 0.95 MEN1 (0.40) MEN1ALDH1A1KMT2AKDM4ELMNA
SCHEMBL110491 0.90 ACHE (0.39) MEN1ALDH1A1KMT2AMAOADRD2
SCHEMBL29915678 0.90 ACHE (0.39) MEN1ALDH1A1KMT2AMAOADRD2
Bromide SCHEMBL9480751 0.88 DRD2 (0.40) MEN1ALDH1A1KMT2AMAOADRD2
SCHEMBL1884804 0.87 S1PR1 (0.41) HTTMAOAACHE
SCHEMBL107921 0.85 NOTUM (0.40) MAOADRD2DRD4DRD1DRD5
SCHEMBL29803467 0.85 NOTUM (0.40) MAOADRD2DRD4DRD1DRD5
Bromide SCHEMBL9480957 0.84 DRD2 (0.40) KDM4EMAPTMAOADRD2DRD4
SCHEMBL14235439 0.84 MEN1 (0.40) MEN1ALDH1A1KMT2AKDM4ELMNA

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 1138 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021018445-A1 OXIDANT-FREE METHOD FOR DYEING KERATIN MATERIAL, COMPRISING THE APPLICATION OF AN ORGANIC C1-C6-ALKOXY SILANE AND AN OXIDANT-FREE DYE PRECURSOR HENKEL AG & CO. KGAA (DE) 2021-02-04 — — WO claimed
EP-2037871-B1 OXIDATION DYES FOR DYEING KERATIN FIBERS CONTAINING ATMOSPHERIC OXYGEN AS THE ONLY OXIDIZING AGENT HENKEL AG & CO KGAA (DE) 2016-02-24 — — EP claimed
US-8734530-B2 Colorants in foam form HENKEL AG & CO. KGAA (DE) 2014-05-27 — — US claimed
EP-2606935-A2 Air oxidative hair dye for glossy dyeings Henkel AG&Co. KGAA (DE) 2013-06-26 — — EP claimed
US-20130125917-A1 COLORANTS IN FOAM FORM HENKEL AG & CO. KGAA (DE) 2013-05-23 — — US claimed
EP-2593071-A2 COLORANTS IN FOAM FORM Henkel AG & Co. KGaA (DE) 2013-05-22 — — EP claimed
WO-2012007219-A2 COLORANTS IN FOAM FORM HENKEL AG & CO. KGAA (DE) 2012-01-19 — — WO claimed
EP-2026755-A2 APPLICATION DEVICE FOR USING AN APPLICATION LIQUID ON KERATIN FIBERS Henkel AG & Co. KGaA (DE) 2009-02-25 — — EP claimed
EP-1433470-B1 Composition for dyeing keratinous fibres HENKEL KGAA (DE) 2008-03-26 — — EP claimed
EP-1286647-B1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS HENKEL KGAA (DE) 2008-01-09 — — EP claimed
WO-2004026272-A1 HAIR TREATMENT AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-04-01 — — WO claimed
US-20030167578-A1 Novel coupling component for oxidative hair dyes HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2003-09-11 — — US claimed
US-20030131425-A1 Containing an indoline, an indole, or a derivative thereof in combination with at least one amino acid or oligopeptide. HOEFFKES HORST (DE) 2003-07-17 — — US claimed
US-6537330-B1 Indoline hair dye with at least one amino acid or oligopeptide; atmospheric oxygen as the sole oxidizing agent; restores grey hair to its natural color, even originally dark to black hair HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-03-25 — — US claimed
EP-1292266-A2 NOVEL COUPLING COMPONENT FOR OXIDATIVE HAIR DYES Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-19 — — EP claimed
EP-1286646-A1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-05 — — EP claimed
EP-1286647-A1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-05 — — EP claimed
WO-2001097756-A2 NOVEL COUPLING COMPONENT FOR OXIDATIVE HAIR DYES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 — — WO claimed
WO-2001093818-A1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-13 — — WO claimed
WO-2001093819-A1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-13 — — 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 (2 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-20130125917-A1 COLORANTS IN FOAM FORM KRT18, FH, FLNA MEN1 4114/4885ALDH1A1 240/4885KMT2A 1211/4885
US-20030167578-A1 Novel coupling component for oxidative hair dyes MAOB, CYB5R3, MAOA MEN1 2470/4885ALDH1A1 131/4885KMT2A 2113/4885

“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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