SCHEMBL540787

SCHEMBL540787

CCCC1CNCCO1.CCCCCN

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
DNM1 Q05193 8/20 0.38
SLC6A4 P31645 6/20 0.38
SLC6A2 P23975 5/20 0.38
SLC6A3 Q01959 5/20 0.38
ALDH1A1 P00352 2/20 0.38
HTR2A P28223 2/20 0.38
ADRB2 P07550 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38
ADRA2C P18825 1/20 0.35

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
Lactic Acid SCHEMBL28188149 0.88 EPHX1 (0.33) EPHX1SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL13575909 0.86
SCHEMBL302007 0.86
SCHEMBL13575910 0.86
SCHEMBL8557599 0.84 SLC6A2 (0.36) EPHX1SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL40488 0.84 EPHX1 (0.57) EPHX1SLC6A4SLC6A2SLC6A3ALDH1A1
Hydrochloric Acid SCHEMBL8005749 0.84 SLC6A2 (0.44) EPHX1SLC6A4SLC6A2SLC6A3HTR2A
Bromide SCHEMBL11217003 0.84 SLC6A2 (0.44) EPHX1SLC6A4SLC6A2SLC6A3HTR2A
Ammonia Solution, Strong SCHEMBL181626 0.84 SLC6A2 (0.44) EPHX1SLC6A4SLC6A2SLC6A3HTR2A
Water SCHEMBL28101465 0.84 SLC6A2 (0.44) EPHX1SLC6A4SLC6A2SLC6A3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3035907-B1 COSMETIC COMPOSITION COMPRISING AMINO SILICONES, CATIONIC SURFACTANTS AND SPECIFIC ESTERS AND A PROCESS FOR A COSMETIC TREATMENT OREAL (FR) 2019-04-03 EP claimed
EP-1707183-B2 Dye composition comprising a non-ionic associative polymer, process for dyeing keratin fibres using same OREAL (FR) 2018-04-25 EP claimed
EP-2677995-B1 COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING A DIRECT DYE BEARING A DISULFIDE/THIOL FUNCTION, A NONIONIC SURFACTANT, AN AMPHOTERIC SURFACTANT, AN ALKALINE AGENT AND A REDUCING AGENT L'ORÉAL (FR) 2017-04-26 EP claimed
EP-2074983-B1 Method for preparing a cationic nanoemulsion and cosmetic composition L'ORÉAL (FR) 2017-03-15 EP claimed
EP-1674075-B1 Hair colouring process comprising a cleaning step ORÉAL L (FR) 2016-07-20 EP claimed
EP-1707182-B2 Dye composition comprising a fatty acid ester and process for dyeing keratin fibres using the same ORÉAL L (FR) 2014-09-10 EP claimed
EP-1707190-B1 Dye composition comprising a hydrophobically modified nonionic cellulose and method for dyeing keratin fibres using it OREAL (FR) 2010-10-20 EP claimed
EP-1707182-B1 Dye composition comprising a fatty acid ester and process for dyeing keratin fibres using the same OREAL (FR) 2010-10-20 EP claimed
EP-2196181-A2 Cosmetic composition comprising at least one ortho-diphenol, one metal salt, hydrogen peroxide, (bi)carbonate and a surface-active agent, and dyeing method based on the composition L'Oreal (FR) 2010-06-16 EP claimed
EP-1707183-B1 Dye composition comprising a non-ionic associative polymer, process for dyeing keratin fibres using same OREAL (FR) 2010-03-03 EP claimed
EP-1674075-A1 Colored hair treating process with a composition comprising a specific non ionic surfactant and use to protect the coloration L'OREAL (FR) 2006-06-28 EP claimed
WO-2006013270-A2 COSMETIC COMPOSITIONS CONTAINING AT LEAST ONE SURFACTANT AND AT LEAST ONE ETHYLENE COPOLYMER WITH POLYETHYLENE GLYCOL GRAFTS L'ORÉAL (FR) 2006-02-09 WO claimed
WO-2005092275-A1 COSMETIC COMPOSITION COMPRISING A DENDRITIC POLYMER WITH PERIPHERAL FATTY CHAINS, A SURFACTANT AND A COSMETIC AGENT, AND USES THEREOF L'OREAL (FR) 2005-10-06 WO claimed
EP-1438951-A1 Ready-to-use bleaching compositions, preparation process thereof and bleaching process therewith L'OREAL (FR) 2004-07-21 EP claimed
EP-1430867-A1 Process to prepare a cationic nanoemulsion, and cosmetic composition. L'OREAL (FR) 2004-06-23 EP claimed
US-6692539-B2 Cationic or amphoteric polymer whose cationic charge density is greater than or equal to 2 meq/gram. L'OREAL (FR) 2004-02-17 US claimed
US-20030172473-A1 Composition useful for the oxidation dyeing of keratin fibres, containing an oxyalkylenated carboxylic acid ether, a nonionic surfactant and a particular polymer L'OREAL (FR) 2003-09-18 US claimed
EP-1329216-A1 Composition for oxidative dyeing of keratinous fibers containing an oxyalkylene ether carboxylic acid, a non-ionic surfactant and a particulate polymer L'OREAL (FR) 2003-07-23 EP claimed
EP-1152735-A1 COSMETIC COMPOSITIONS CONTAINING A QUATERNARY SILICON AND A PEARLING AGENT AND THEIR USES L'OREAL (FR) 2001-11-14 EP claimed
WO-2001041719-A1 COSMETIC COMPOSITIONS CONTAINING A QUATERNARY SILICON AND A PEARLING AGENT AND THEIR USES L'OREAL (FR) 2001-06-14 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 (1 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-20030172473-A1 Composition useful for the oxidation dyeing of keratin fibres, containing an oxyalkylenated carboxylic acid ether, a nonionic surfactant and a particular polymer KRT18, KRTCAP2, CUTA EPHX1 2159/4885DNM1 1868/4885SLC6A4 2828/4885

“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.