SCHEMBL3147374

SCHEMBL3147374

CCCCCCCCC=CCCCCCCCC[N+](C)(C)CCCCCCCCC=CCCCCCCCC.COS(=O)(=O)[O-]

nearest known ligand 0.48

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
DNM1 Q05193 6/20 0.47
LMNA P02545 1/20 0.44
FAAH O00519 2/20 0.43
TRPV1 Q8NER1 1/20 0.43
ENPP2 Q13822 1/20 0.42
PPARA Q07869 2/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL3147360 1.00 HTT (0.48) HTTDNM1LMNAFAAHTRPV1
SCHEMBL11874044 0.97 HTT (0.44) HTTDNM1LMNAFAAHTRPV1
SCHEMBL6558322 0.94 ENPP2 (0.47) HTTDNM1LMNAFAAHTRPV1
SCHEMBL10908129 0.90 ENPP2 (0.51) DNM1FAAHTRPV1ENPP2PPARA
SCHEMBL10908132 0.90 ENPP2 (0.51) DNM1FAAHTRPV1ENPP2PPARA
SCHEMBL7767862 0.90 HTT (0.60) HTTDNM1LMNAKMT2A
SCHEMBL10420709 0.90 HTT (0.60) HTTDNM1LMNAKMT2A
SCHEMBL10806075 0.90 HTT (0.60) HTTDNM1LMNAKMT2A
SCHEMBL1547985 0.90 HTT (0.60) HTTDNM1LMNAKMT2A
SCHEMBL5803866 0.90 HTT (0.60) HTTDNM1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170255725-A1 SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS PROCTER & GAMBLE (US) 2017-09-07 US disclosed
EP-3197425-A1 SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS The Procter and Gamble Company (US) 2017-08-02 EP disclosed
US-20160090557-A1 SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2016-03-31 US disclosed
WO-2016049404-A1 SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
US-7704938-B2 Compositions for lipophilic fluid systems comprising a siloxane-based/non-ionic surfactant mixture THE PROCTER & GAMBLE COMPANY (US) 2010-04-27 US disclosed
US-20100081602-A1 Fabric treatment mixture of decamethylcyclopentasiloxane, a siloxane-based surfactant, a nonionic surfactant, propylene glycol; improved cleaning of water sensitive fabrics DEAK JOHN CHRISTOPHER 2010-04-01 US disclosed
US-7323014-B2 Down the drain cleaning system THE PROCTER & GAMBLE COMPANY (US) 2008-01-29 US disclosed
US-7244699-B2 Silicone polymers for lipophilic fluid systems THE PROCTER & GAMBLE COMPANY (US) 2007-07-17 US disclosed
US-20060247147-A1 Compositions for lipophilic fluid systems DEAK JOHN C 2006-11-02 US disclosed
US-7101835-B2 Compositions for lipophilic fluid systems comprising 1,2-hexanediol PROCTER & GAMBLE COMPANY (US) 2006-09-05 US disclosed
EP-1123374-A1 FABRIC CARE COMPOSITION AND METHOD THE PROCTER & GAMBLE COMPANY (US) 2001-08-16 EP disclosed
US-6107270-A DRYER-ACTIVATED SHEETS CONTAINING A DYE TRANSFER INHIBITOR AS A COLOR PROTECTING INGREDIENT AND A CHLORINE SCAVENGER ACTIVE IN THE NEXT WASH CYCLE, FOR CLOTHING, WEAR RESISTANCE THE PROCTER & GAMBLE COMPANY (US) 2000-08-22 US disclosed
EP-1017771-A1 DRYER-ADDED FABRIC SOFTENER COMPOSITION COMPRISING CHLORINE SCAVENGER TO PROVIDE COLOR AND OTHER FABRIC BENEFITS THE PROCTER & GAMBLE COMPANY (US) 2000-07-12 EP disclosed
WO-2000024851-A2 FABRIC CARE COMPOSITION AND METHOD THE PROCTER & GAMBLE COMPANY (US) 2000-05-04 WO disclosed
WO-2000024856-A1 FABRIC CARE COMPOSITION AND METHOD THE PROCTER & GAMBLE COMPANY (US) 2000-05-04 WO disclosed
US-6046155-A FOR ADDING TO AUTOMATIC LAUNDRY DRIERS WITH FABRICS FOR FABRIC CARE APPEARANCE THE PROCTER & GAMBLE COMPANY (US) 2000-04-04 US disclosed
US-6046154-A FOR ADDING TO AUTOMATIC LAUNDRY DRIERS WITH FABRICS FOR FABRIC CARE APPEARANCE THE PROCTER & GAMBLE COMPANY (US) 2000-04-04 US disclosed
US-6025321-A SUBSTRATE WITH FABRIC SOFTENER COMPOSITION HAVING SPECIFIED PHYSICAL PROPERTIES, CHELANT COLOR CARE AGENT THE PROCTER & GAMBLE COMPANY (US) 2000-02-15 US disclosed
WO-1999015611-A1 DRYER-ADDED FABRIC SOFTENER COMPOSITION USAGE TO PROVIDE COLOR AND OTHER FABRIC APPEARANCE BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1999-04-01 WO disclosed
WO-1999015612-A1 DRYER-ADDED FABRIC SOFTENER COMPOSITION COMPRISING CHLORINE SCAVENGER TO PROVIDE COLOR AND OTHER FABRIC BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1999-04-01 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 (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-20170255725-A1 SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS TYR, ME1, LPO HTT 3635/4885DNM1 1784/4885LMNA 4101/4885

“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.