SCHEMBL6945176

SCHEMBL6945176

CC(C)(C)CCN.COS(=O)(=O)O

nearest known ligand 0.33

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 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
APP P05067 1/20 0.31

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
SCHEMBL28364518 0.84 FDPS (0.37) LMNABLMCA1CA2APP
SCHEMBL14784995 0.83 CA2 (0.36) LMNASLC6A6CYP2C19BLMCA1
SCHEMBL28154935 0.75 TSHR (0.44) CA1CA2
Propylamine SCHEMBL7726532 0.75 LMNA (0.39) LMNASLC6A6CYP2C19BLMCA1
Monoethanolamine SCHEMBL540866 0.75 TSHR (0.44) LMNASLC6A6CYP2C19BLMCA1
SCHEMBL5906890 0.75 APP (0.48) LMNASLC6A6CYP2C19BLMCA1
Ethylamine SCHEMBL3467386 0.75
SCHEMBL4969598 0.75
SCHEMBL29044695 0.74 CA12 (0.48) LMNACYP2C19CA1CA2APP
SCHEMBL9707 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3966305-A1 HARD SURFACE CLEANING COMPOSITIONS COMPRISING ALKOXYLATED PHENOLS AND PERFUMES AND CLEANING PADS AND METHODS FOR USING SUCH CLEANING COMPOSITIONS The Procter & Gamble Company (US) 2022-03-16 EP disclosed
EP-0946699-B1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY PROCTER & GAMBLE (US) 2003-10-15 EP disclosed
US-6277796-B1 ACETAL COMPOUND THE PROCTER & GAMBLE COMPANY 2001-08-21 US disclosed
EP-0946705-A2 DRYER ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1999-10-06 EP disclosed
EP-0946699-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 1999-10-06 EP disclosed
EP-0946700-A1 RINSE-ADDED AND DRYER-ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF ESTER FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1999-10-06 EP disclosed
US-5830835-A FABRIC SOFTENER, PERFUME ESTER MIXTURES PROCTER & GAMBLE COMPANY (US) 1998-11-03 US disclosed
WO-1998027192-A2 DRYER ADDED FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-06-25 WO disclosed
WO-1998027191-A1 RINSE-ADDED AND DRYER-ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF ESTER FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1998-06-25 WO disclosed
WO-1998027190-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 1998-06-25 WO disclosed
EP-0843717-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 1998-05-27 EP disclosed
WO-1997003173-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed
US-5559088-A DIESTERS OF NON-ALLYLIC ALCOHOLS SLOWLY HYDROLYZE TO RELEASE PERFUME GRADUALLY THE PROCTOR & GAMBLE COMPANY (US) 1996-09-24 US disclosed