SCHEMBL2496049

SCHEMBL2496049

C[N+](C)(C)CCOC(=O)Oc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.44
MMP9 P14780 2/20 0.44
MMP14 P50281 2/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
CHRM1 P11229 6/20 0.41
CHRM3 P20309 6/20 0.41
CHRM2 P08172 5/20 0.41
CHRM4 P08173 5/20 0.41
CHRM5 P08912 4/20 0.41
HTR1A P08908 2/20 0.41
CHRNB2 P17787 2/20 0.41
CHRNA7 P36544 2/20 0.41
CHRNA4 P43681 2/20 0.41
ADRA2A P08913 1/20 0.41
ADRA1A P35348 1/20 0.41
PGR P06401 1/20 0.41
TBXA2R P21731 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 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
SCHEMBL6708532 0.98 MMP2 (0.43) MMP2MMP9MMP14BCHEACHE
SCHEMBL6328139 0.87 MMP2 (0.44) MMP2MMP9MMP14CHRM1CHRM3
SCHEMBL10414955 0.85 MMP2 (0.44) MMP2MMP9MMP14CHRM1CHRM3
SCHEMBL7739008 0.84 MMP2 (0.59) MMP2MMP9MMP14SMN1; SMN2MMP8
SCHEMBL9763647 0.84 MMP2 (0.43) MMP2MMP9MMP14CHRM1CHRM3
SCHEMBL10414159 0.83 CHRM2 (0.40) MMP2MMP9MMP14BCHEACHE
SCHEMBL10775761 0.83 MMP2 (0.57) MMP2MMP9MMP14SMN1; SMN2MMP8
SCHEMBL9763964 0.82 CHRM2 (0.39) MMP2MMP9MMP14BCHEACHE
SCHEMBL9319965 0.82 MLNR (0.43) MMP2MMP9MMP14CHRM1CHRM3
Hydrochloric Acid SCHEMBL9320020 0.82 MMP9 (0.42) MMP2MMP9MMP14ACHESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0653485-B1 Detergent composition UNILEVER NV (NL) 2000-05-17 EP claimed
EP-0851024-A2 Machine dishwashing tablets delivering a rinse aid benefit UNILEVER N.V. (NL) 1998-07-01 EP claimed
EP-0826024-A1 AUTOMATIC DISHWASHING COMPOSITIONS CONTAINING ALUMINUM SALTS UNILEVER N.V. (NL) 1998-03-04 EP claimed
US-5698506-A Automatic dishwashing compositions containing aluminum salts LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-12-16 US claimed
WO-1996036687-A1 AUTOMATIC DISHWASHING COMPOSITIONS CONTAINING ALUMINUM SALTS UNILEVER N.V. (NL) 1996-11-21 WO claimed
US-5480576-A SILVER ANTITARNISH LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-01-02 US claimed
US-5468410-A Antitarnish for silver LEVER BROTHERS COMPANY 1995-11-21 US claimed
US-5441660-A Detergents containing surfactants soaps and mixtures, and a capsule having polymeric shell surrounding oil dispersion while oil dispersion containing active agents like enzymes, peracids, bleach, bleach activator /catalysts and brighteners LEVER BROTHERS COMPANY (US) 1995-08-15 US claimed
US-5434069-A Cleaning compounds LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1995-07-18 US claimed
EP-0653485-A1 Detergent composition UNILEVER N.V. (NL) 1995-05-17 EP claimed
US-5153348-A Ester exchanging a choline salt with carbonate esters in aprotic solvents and solidification LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-10-06 US claimed
EP-0369512-B1 OLEUM SULPHONATION PROCESS UNILEVER N.V. (NL) 1992-08-12 EP claimed
EP-0475512-A1 Process for preparing quaternary ammonium carbonate esters UNILEVER N.V. (NL) 1992-03-18 EP claimed
EP-0475513-A1 Process for preparing quaternary ammonium carbonate esters UNILEVER N.V. (NL) 1992-03-18 EP claimed
US-4988451-A DETERGENTS, STABILIZERS, DISPERSANTS, SURFACTANTS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1991-01-29 US claimed
EP-0402971-A2 Particulate detergent composition additive UNILEVER N.V. (NL) 1990-12-19 EP claimed
US-4931563-A USING OLEUM WITH CONTROLLED SULFUR TRIOXIDE CONTENT LEVER BROTHERS COMPANY (US) 1990-06-05 US claimed
EP-0369512-A1 Oleum sulphonation process UNILEVER N.V. (NL) 1990-05-23 EP claimed
EP-0284132-A2 Quaternary ammonium or phosphonium peroxy carbonic acid precursors and their use in detergent bleach compositions UNILEVER N.V. (NL) 1988-09-28 EP claimed
US-4751015-A LOW TEMPERATURE BLEACH LEVER BROTHERS COMPANY (US) 1988-06-14 US claimed