SCHEMBL2850499

SCHEMBL2850499

C=C(C)C(=O)OC(C)C(C)(C)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.36

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
Ammonia Solution, Strong SCHEMBL19133679 0.81 TSHR (0.38) TSHRALDH1A1
SCHEMBL2437214 0.80 TSHR (0.41) TSHRALDH1A1TDP1
SCHEMBL3081441 0.79 TSHR (0.43) TSHRALDH1A1TDP1
SCHEMBL1815348 0.79 TSHR (0.43) TSHRALDH1A1TDP1
Bromide SCHEMBL986819 0.78 TSHR (0.39) TSHRALDH1A1TDP1
Hydrochloric Acid SCHEMBL717360 0.78 TSHR (0.39) TSHRALDH1A1TDP1
SCHEMBL28469028 0.78 TSHR (0.42) TSHRALDH1A1
SCHEMBL12493193 0.77 LMNA (0.39) TSHRTDP1
SCHEMBL23494394 0.76 TSHR (0.41) TSHRALDH1A1
SCHEMBL12856975 0.76 TSHR (0.41) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250115832-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-04-10 US claimed
EP-4384312-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2024-06-19 EP claimed
WO-2023017014-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2023-02-16 WO claimed
US-20080078036-A1 Dye composition for keratin fibers, with a cationic direct dye and a substantive polymer L'OREAL S.A. (FR) 2008-04-03 US claimed
EP-0975318-B1 OXIDIZING COMPOSITION AND USES FOR DYEING, PERMANENTLY SETTING OR BLEACHING KERATIN FIBRES OREAL (FR) 2005-06-08 EP claimed
US-6899739-B2 Dye composition for keratin fibres, with a cationic direct dye and a substantive polymer L'OREAL S.A. (FR) 2005-05-31 US claimed
EP-0953334-B1 Composition for dying keratinous fibres with a direct cationic dye and a substantive polymer OREAL (FR) 2004-10-20 EP claimed
EP-0960617-B1 Composition for dying keratinous fibres with a direct cationic dye and a sustaining polymer OREAL (FR) 2004-10-06 EP claimed
US-20030229950-A1 Dye composition for keratin fibres, with a cationic direct dye and a substantive polymer L'OREAL S.A. 2003-12-18 US claimed
US-6592633-B2 Less selective colorations and which are particularly resistant to the various attacking factors to which the hair may be subjected L'OREAL S.A. (FR) 2003-07-15 US claimed
US-6471730-B1 READY TO USE HAIR DYE CONTAINING OXIDATION COLORING AGENT, CATIONIC POLYMERS AND ENZYME; HYDROGEN PEROXIDE FREE; HOMOGENEOUS, INTENSE; NONDEGRADING OR DECOLOURING OF KERATINOUS FIBERS L'OREAL (FR) 2002-10-29 US claimed
US-20020046432-A1 DYE COMPOSITION FOR KERATIN FIBRES, WITH A CATIONIC DIRECT DYE AND A SUBSTANTIVE POLYMER RONDEAU CHRISTINE (FR) 2002-04-25 US claimed
US-20020007521-A1 DYE COMPOSITION FOR KERATIN FIBRES, WITH A CATIONIC DIRECT DYE AND A SUBSTANTIVE POLYMER L'OREAL S.A. (FR) 2002-01-24 US claimed
EP-1047377-B1 DYEING COMPOSITION CONTAINING A LACCASE AND KERATINOUS FIBRE DYEING METHODS USING SAME OREAL (FR) 2001-06-27 EP claimed
US-6251145-B1 ENZYME OF 2-ELECTRON OXIDOREDUCTASE TYPE IN THE PRESENCE OF AT LEAST ONE DONOR FOR THE SAID ENZYME; CATIONIC POLYMER L'OREAL S.A. (FR) 2001-06-26 US claimed
EP-1047377-A1 DYEING COMPOSITION CONTAINING A LACCASE AND KERATINOUS FIBRE DYEING METHODS USING SAME L'OREAL (FR) 2000-11-02 EP claimed
EP-0975318-A1 OXIDISING COMPOSITION AND USES FOR DYEING, PERMANENTLY SETTING OR BLEACHING KERATIN FIBRES L'OREAL (FR) 2000-02-02 EP claimed
EP-0953334-A2 Composition for dying keratinous fibres with a direct cationic dye and a substantive polymer L'OREAL (FR) 1999-11-03 EP claimed
WO-1999036035-A1 DYEING COMPOSITION CONTAINING A LACCASE AND KERATINOUS FIBRE DYEING METHODS USING SAME L'OREAL (FR) 1999-07-22 WO claimed
WO-1999017727-A1 OXIDISING COMPOSITION AND USES FOR DYEING, PERMANENTLY SETTING OR BLEACHING KERATIN FIBRES L'OREAL (FR) 1999-04-15 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 (4 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-20080078036-A1 Dye composition for keratin fibers, with a cationic direct dye and a substantive polymer KRT18, DSG1, KRTCAP2 TSHR 4757/4885ALDH1A1 1233/4885TDP1 2273/4885
US-20020046432-A1 DYE COMPOSITION FOR KERATIN FIBRES, WITH A CATIONIC DIRECT DYE AND A SUBSTANTIVE POLYMER KRT18, DSG1, KRTCAP2 TSHR 4767/4885ALDH1A1 1357/4885TDP1 2204/4885
US-20020007521-A1 DYE COMPOSITION FOR KERATIN FIBRES, WITH A CATIONIC DIRECT DYE AND A SUBSTANTIVE POLYMER KRT18, DSG1, KRTCAP2 TSHR 4754/4885ALDH1A1 1342/4885TDP1 2242/4885
US-20030229950-A1 Dye composition for keratin fibres, with a cationic direct dye and a substantive polymer KRT18, DSG1, KRTCAP2 TSHR 4757/4885ALDH1A1 1496/4885TDP1 2252/4885

“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.