SCHEMBL110491

SCHEMBL110491

CCCCN1CCc2cc(O)c(O)cc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.39
▸ MAOA P21397 1/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ S1PR1 P21453 1/20 0.38
▸ DRD2 P14416 3/20 0.38
▸ DRD3 P35462 2/20 0.38
▸ DRD1 P21728 1/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ DRD5 P21918 1/20 0.37
▸ APOBEC3A P31941 1/20 0.37
▸ APOBEC3G Q9HC16 1/20 0.37
▸ CRHR1 P34998 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ KMT2A Q03164 1/20 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
SCHEMBL29915678 1.00 ACHE (0.39) ACHEMAOAGRM5S1PR1DRD2
Bromide SCHEMBL9480751 0.98 DRD2 (0.40) ACHEMAOAGRM5S1PR1DRD2
SCHEMBL1884804 0.94 S1PR1 (0.41) ACHEMAOAS1PR1
SCHEMBL29915622 0.90 MEN1 (0.42) ACHEMAOADRD2DRD1DRD4
SCHEMBL111871 0.90 MEN1 (0.42) ACHEMAOADRD2DRD1DRD4
SCHEMBL28673277 0.86 MEN1 (0.44) ACHEMEN1ALDH1A1KMT2A
SCHEMBL107921 0.82 NOTUM (0.40) ACHEMAOADRD2DRD1DRD4
SCHEMBL29803467 0.82 NOTUM (0.40) ACHEMAOADRD2DRD1DRD4
SCHEMBL14235439 0.81 MEN1 (0.40) MAOADRD2DRD1DRD4DRD5
Bromide SCHEMBL9480957 0.81 DRD2 (0.40) ACHEMAOADRD2DRD1DRD4

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 1219 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-2582351-B1 HAIR DYEING PROCESS USING A COMPOSITION COMPRISING AT LEAST ONE INDOLE OR INDOLINE COMPOUND, A METAL SALT, HYDROGEN PEROXIDE AND A BASIFYING AGENT L'ORÉAL (FR) 2017-08-02 — — EP claimed
EP-2623093-B1 DYE FOR KERATIN FIBERS USING BILIRUBIN OXIDASE AND INDOLE DERIVATIVES AMANO ENZYME INC (JP) 2016-05-25 — — EP 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-20140359950-A1 DYEING OF KERATIN FIBERS USING INDOLE ANALOGUE AMANO ENZYME INC. (JP) 2014-12-11 — — US claimed
US-8734530-B2 Colorants in foam form HENKEL AG & CO. KGAA (DE) 2014-05-27 — — US claimed
US-8597373-B2 Hair dyeing process using a composition comprising at least one indole or indoline compound, a metal salt, hydrogen peroxide and a basifying agent L'OREAL (FR) 2013-12-03 — — US claimed
US-20130174864-A1 HAIR DYEING PROCESS USING A COMPOSITION COMPRISING AT LEAST ONE INDOLE OR INDOLINE COMPOUND, A METAL SALT, HYDROGEN PEROXIDE AND A BASIFYING AGENT L'OREAL (FR) 2013-07-11 — — 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
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
CN-1047592-C Tinctorial composition of 5,6-dihydroxyindole and dyeing method of keratose fibre OREAL (FR) 1999-12-22 — — CN claimed
EP-0462857-B2 Dyeing composition containing 5-6 dihydroxyindolines and keratinous fibres dyeing process OREAL (FR) 1998-03-04 — — EP claimed
US-5690697-A COMPOSITION OF AN INDOLE OR INDOLINE COMPOUND, A MANGANESE SALT, A BASIFYING AGENT AND AN OXIDIZER L'OREAL (FR) 1997-11-25 — — US claimed
EP-0697209-B1 Set, process, device and keratineous fibres dyeing composition OREAL (FR) 1996-10-09 — — EP claimed
EP-0697210-B1 Use of a manganese, zinc and/or cobalt salt in a two-steps dyeing process based on an ondole or indoline compound OREAL (FR) 1996-09-25 — — EP claimed
US-5538517-A NONDESTRUCTIVE HAIR DYES L'OREAL (FR) 1996-07-23 — — US claimed
EP-0645999-B1 METHOD FOR DYEING KERATIN FIBRES WITH INDOLE OR INDOLIN DERIVATIVES, HYDROGEN PEROXIDE AND A PEROXIDASE OREAL (FR) 1996-01-31 — — EP claimed
US-5178637-A Hair dyes L'OREAL (FR) 1993-01-12 — — US 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 ACHE 1098/4885MAOA 217/4885GRM5 3845/4885
US-20130174864-A1 HAIR DYEING PROCESS USING A COMPOSITION COMPRISING AT LEAST ONE INDOLE OR INDOLINE COMPOUND, A METAL SALT, HYDROGEN PEROXIDE AND A BASIFYING AGENT KRT18, HCN4, IDO1 ACHE 512/4885MAOA 18/4885GRM5 2454/4885

“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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