SCHEMBL1601855

SCHEMBL1601855

CCCCCCCCCCCCCCCCCCCC(=O)NC(CCC)N(C)C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPK1 P28482 1/20 0.59
DNM1 Q05193 3/20 0.53
NOD1 Q9Y239 3/20 0.53
PLA2G2C Q5R387 1/20 0.53
HSP90AA1 P07900 1/20 0.50
PLA2G10 O15496 2/20 0.49
CNR2 P34972 2/20 0.46
DEGS1 O15121 1/20 0.44
ASAH2 Q9NR71 1/20 0.44
CPT2 P23786 1/20 0.44
CPT1A P50416 1/20 0.44
CPT1B Q92523 1/20 0.44

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
SCHEMBL1603003 1.00 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL5196744 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL94325 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL8660979 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL67008 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL319255 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL90356 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL3657071 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL19281111 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1
SCHEMBL221642 0.89 FAAH (0.59) FAAHMEN1KMT2AMAPK1DNM1

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 8 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-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
WO-2008152595-A2 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE THE PROCTER & GAMBLE COMPANY (US) 2008-12-18 WO disclosed
US-20080311068-A1 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE THE PROCTER & GAMBLE COMPANY 2008-12-18 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 (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 FAAH 600/4885MEN1 1992/4885KMT2A 1956/4885
US-20080311068-A1 HAIR CONDITIONING COMPOSITION COMPRISING AMINE-TYPE CATIONIC SURFACTANT AND DIRECT DYE SLC7A1, SLC7A5, SLC25A20 FAAH 1219/4885MEN1 2720/4885KMT2A 1429/4885

“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.