SCHEMBL1603004

SCHEMBL1603004

CCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCN(C)C

nearest known ligand 0.90

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.90
CASP2 P42575 1/20 0.65
FAAH O00519 5/20 0.62
NAAA Q02083 1/20 0.61
EPHX2 P34913 3/20 0.56
SLC6A5 Q9Y345 2/20 0.55
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51

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
SCHEMBL9549112 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL19479185 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL1601857 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL27964228 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL9665089 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL18632644 1.00 DNM1 (0.90) DNM1CASP2FAAHNAAAEPHX2
Hydrochloric Acid SCHEMBL68511 0.98 DNM1 (0.87) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL21419343 0.97 DNM1 (0.84) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL22907946 0.97 DNM1 (0.84) DNM1CASP2FAAHNAAAEPHX2
SCHEMBL22907873 0.97 DNM1 (0.84) DNM1CASP2FAAHNAAAEPHX2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9126057-B2 Hair conditioning composition comprising cationic surfactant system and direct dye THE PROCTER & GAMBLE COMPANY (US) 2015-09-08 US disclosed
EP-2155336-B1 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE PROCTER & GAMBLE (US) 2014-10-29 EP disclosed
EP-2355904-A2 HAIR CONDITIONING COMPOSITION COMPRISING CATIONIC SURFACTANT SYSTEM AND DIRECT DYE The Procter & Gamble Company (US) 2011-08-17 EP disclosed
US-7918901-B2 Hair conditioning composition comprising amine-type cationic surfactant and direct dye THE PROCTER & GAMBLE COMPANY (US) 2011-04-05 US disclosed
US-20100150858-A1 Hair Conditioning Composition Comprising Cationic Surfactant System and Direct Dye THE PROCTER & GAMBLE COMPANY 2010-06-17 US disclosed
WO-2010068400-A2 HAIR CONDITIONING COMPOSITION COMPRISING CATIONIC SURFACTANT SYSTEM AND DIRECT DYE THE PROCTER & GAMBLE COMPANY (US) 2010-06-17 WO disclosed
EP-2155336-A2 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE The Procter & Gamble (US) 2010-02-24 EP disclosed
US-20080311068-A1 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE THE PROCTER & GAMBLE COMPANY 2008-12-18 US disclosed
WO-2008152595-A2 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE THE PROCTER & GAMBLE COMPANY (US) 2008-12-18 WO 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 (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-20100150858-A1 Hair Conditioning Composition Comprising Cationic Surfactant System and Direct Dye TRPC5, SLC25A20, TRPA1 DNM1 3097/4885CASP2 3460/4885FAAH 600/4885
US-20080311068-A1 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE SLC7A1, SLC7A5, SLC25A20 DNM1 3103/4885CASP2 2586/4885FAAH 1219/4885

“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.