SCHEMBL250423

SCHEMBL250423

C=CC(=O)C(CN)CS(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.30
LMNA P02545 1/20 0.30
SLC6A6 P31641 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 1/20 0.30

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
SCHEMBL21800933 0.85 LMNA (0.32) GABBR2GABBR1LMNASLC6A6CYP2C19
SCHEMBL28494059 0.78
SCHEMBL21246802 0.74 SLC22A6 (0.34) SLC22A6
SCHEMBL28361531 0.74 GABBR2 (0.36) GABBR2GABBR1SLC22A6LMNASLC6A6
SCHEMBL28407499 0.72 SLC22A6 (0.33) GABBR2GABBR1SLC22A6
SCHEMBL2226362 0.71 TSHR (0.33) SLC22A6
SCHEMBL483957 0.71 ALDH1A1 (0.31)
SCHEMBL27894117 0.71 SLC22A6 (0.32) GABBR2GABBR1SLC22A6
SCHEMBL9696553 0.69 TSHR (0.32) SLC22A6
SCHEMBL5925198 0.69 SLC22A6 (0.31) SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2315615-B1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR USING PERSULFATES, PERBORATES OR PERCARBONATES OREAL (FR) 2019-11-20 EP disclosed
EP-2225003-B1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR USING PERSULFATES, PERBORATES OR PERCARBONATES L'ORÉAL (FR) 2017-10-11 EP disclosed
US-9578944-B2 Compositions and methods for altering the appearance of hair L'OREAL (FR) 2017-02-28 US disclosed
US-9566221-B2 Methods for altering the color and appearance of hair L'OREAL (FR) 2017-02-14 US disclosed
US-9565915-B2 Compositions and methods for altering the appearance of hair L'OREAL (FR) 2017-02-14 US disclosed
US-9565916-B2 Compositions and methods for altering the appearance of hair L'OREAL (FR) 2017-02-14 US disclosed
US-9474700-B2 Methods for altering the color and appearance of hair L'OREAL (FR) 2016-10-25 US disclosed
EP-2315573-B2 METHODS AND KITS FOR PERMANENTLY COLORING HAIR USING A DEVELOPER COMPOSITION CONTAINING AN OXIDIZER COMPOSITION AND A SHAMPOO ORÉAL L (FR) 2016-07-27 EP disclosed
US-20150290093-A1 METHODS FOR ALTERING THE COLOR AND APPEARANCE OF HAIR L'OREAL (FR) 2015-10-15 US disclosed
US-20150265513-A1 METHODS FOR ALTERING THE COLOR AND APPEARANCE OF HAIR L'OREAL (FR) 2015-09-24 US disclosed
US-20130042883-A1 COMPOSITIONS AND METHODS FOR LIGHTENING THE COLOR OF RELAXED OR STRAIGHTENED HAIR L'OREAL (FR) 2013-02-21 US disclosed
US-8163037-B2 Methods and kits for providing lift and then a permanent color to hair L'OREAL (FR) 2012-04-24 US disclosed
US-8088176-B2 Methods and kits for permanently coloring hair using a developer composition containing an oxidizer composition and a shampoo L'OREAL (FR) 2012-01-03 US disclosed
US-20110209720-A1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR USING A DEVELOPER COMPOSITION CONTAINING AN OXIDIZER COMPOSITION AND A SHAMPOO L'OREAL (FR) 2011-09-01 US disclosed
US-20110203605-A1 METHODS AND KITS FOR PROVIDING LIFT AND THEN A PERMANENT COLOR TO HAIR L'OREAL (FR) 2011-08-25 US disclosed
US-7905926-B2 Methods and kits for permanently coloring hair L'ORÉAL (FR) 2011-03-15 US disclosed
US-20100192969-A1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR L'OREAL (FR) 2010-08-05 US disclosed
US-20050129644-A1 Use of hydroxycarboxylic acids and salts thereof as complexing agents in reducing compositions for bleaching or permanently reshaping keratin fibres L'OREAL S.A. (FR) 2005-06-16 US disclosed
US-20050036970-A1 Reducing compositions for bleaching or permanently reshaping keratin fibres comprising polycarboxylic acids and salts thereof as complexing agents L'OREAL S.A. (FR) 2005-02-17 US disclosed
US-20050011017-A1 Oxidizing composition comprising hydroxycarboxylic acids and salts thereof as complexing agents for dyeing, bleaching or permanently reshaping keratin fibres L'OREAL S.A. (FR) 2005-01-20 US 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 (8 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-20050129644-A1 Use of hydroxycarboxylic acids and salts thereof as complexing agents in reducing compositions for bleaching or permanently reshaping keratin fibres RARA, RARB, RARG GABBR2 2105/4885GABBR1 2326/4885SLC22A6 2833/4885
US-20110203605-A1 METHODS AND KITS FOR PROVIDING LIFT AND THEN A PERMANENT COLOR TO HAIR ALDH1A3, COXFA4L2, LDHB GABBR2 1648/4885GABBR1 1362/4885SLC22A6 1641/4885
US-20110209720-A1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR USING A DEVELOPER COMPOSITION CONTAINING AN OXIDIZER COMPOSITION AND A SHAMPOO PPOX, SCO2, SDHB GABBR2 1721/4885GABBR1 1284/4885SLC22A6 2048/4885
US-20150290093-A1 METHODS FOR ALTERING THE COLOR AND APPEARANCE OF HAIR TYR, COXFA4L2, MT-CO3 GABBR2 2969/4885GABBR1 2283/4885SLC22A6 1716/4885
US-20050011017-A1 Oxidizing composition comprising hydroxycarboxylic acids and salts thereof as complexing agents for dyeing, bleaching or permanently reshaping keratin fibres HAO2, KRT18, RARA GABBR2 2910/4885GABBR1 2890/4885SLC22A6 3095/4885
US-20150265513-A1 METHODS FOR ALTERING THE COLOR AND APPEARANCE OF HAIR COXFA4L2, TYR, COX5A GABBR2 2126/4885GABBR1 1704/4885SLC22A6 1707/4885
US-20100192969-A1 METHODS AND KITS FOR PERMANENTLY COLORING HAIR CYB5R3, COXFA4L2, PPOX GABBR2 1923/4885GABBR1 1480/4885SLC22A6 2089/4885
US-20050036970-A1 Reducing compositions for bleaching or permanently reshaping keratin fibres comprising polycarboxylic acids and salts thereof as complexing agents RARA, RARB, KRT18 GABBR2 2646/4885GABBR1 3230/4885SLC22A6 3108/4885

“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.