SCHEMBL4613048

SCHEMBL4613048

CCCCCCCCCCCCc1ccccc1S(=O)(=O)[O-].CCCCCCCC[N+](C)(C)CCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.49
LIPG Q9Y5X9 1/20 0.43
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
ESR1 P03372 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
CHRM2 P08172 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD2 P14416 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
CHRM3 P20309 1/20 0.42
MAOA P21397 1/20 0.42
CNR1 P21554 1/20 0.42

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
Didecyldimethylammonium SCHEMBL332030 0.94 MLNR (0.47) DNM1LIPGMLNRNR1I2ESR1
SCHEMBL330887 0.94 MLNR (0.47) DNM1LIPGMLNRNR1I2ESR1
Choline SCHEMBL2764559 0.90 LIPG (0.46) LIPGKCNH2LMNAHTTHIF1A
Mecetronium SCHEMBL331508 0.89 HTT (0.45) DNM1LIPGMLNRNR1I2ESR1
SCHEMBL330535 0.86 LIPG (0.45) DNM1LIPGMLNRNR1I2ESR1
SCHEMBL331184 0.86 LIPG (0.45) DNM1LIPGMLNRNR1I2ESR1
SCHEMBL330692 0.86 LIPG (0.45) DNM1LIPGMLNRNR1I2ESR1
SCHEMBL331700 0.86 LIPG (0.45) DNM1LIPGMLNRNR1I2ESR1
Cetrimonium SCHEMBL330808 0.86 LIPG (0.45) DNM1LIPGKCNH2LMNAHTT
SCHEMBL330654 0.86 LIPG (0.45) DNM1LIPGKCNH2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020161082-A1 Copolyesters with antistatic properties and high clarity EASTMAN CHEMICAL COMPANY 2002-10-31 US claimed
US-6454983-B1 COPOLYESTER AND A QUATERNARY AMMONIUM SALT ANTISTATIC AGENT EASTMAN CHEMICAL COMPANY 2002-09-24 US claimed
EP-1165679-A2 COPOLYESTERS WITH ANTISTATIC PROPERTIES AND HIGH CLARITY EASTMAN CHEMICAL COMPANY (US) 2002-01-02 EP claimed
EP-1155075-A1 SINGLE SCREW EXTRUSION OF POLYMERS EASTMAN CHEMICAL COMPANY (US) 2001-11-21 EP claimed
EP-1144509-A2 EXTRUDABLE MASTERBATCH EASTMAN CHEMICAL COMPANY (US) 2001-10-17 EP claimed
US-6271291-B1 COPOLYESTERS WITH DIACIDS AND DIOLS WITH QUATERNARY AMMONIUM SALTS WITH HEAT RESISTANCE FILM, SHEET, AND MOLDED ARTICLES FROM THE MASTERBATCHES. EASTMAN CHEMICAL COMPANY 2001-08-07 US claimed
WO-2000036015-A2 EXTRUDABLE MASTERBATCH EASTMAN CHEMICAL COMPANY (US) 2000-06-22 WO claimed
WO-2000036005-A1 SINGLE SCREW EXTRUSION OF POLYMERS EASTMAN CHEMICAL COMPANY (US) 2000-06-22 WO claimed
WO-2000035989-A2 COPOLYESTERS WITH ANTISTATIC PROPERTIES AND HIGH CLARITY EASTMAN CHEMICAL COMPANY (US) 2000-06-22 WO claimed
EP-1701997-B1 THERMOPLASTIC COMPOSITION CONTAINING POLYMERIC ANTI-STATIC SALT, METHOD OF MAKING, AND USE THEREOF SABIC INNOVATIVE PLASTICS IP (NL) 2008-10-29 EP disclosed
US-20020161082-A1 Copolyesters with antistatic properties and high clarity EASTMAN CHEMICAL COMPANY 2002-10-31 US disclosed
US-6454983-B1 COPOLYESTER AND A QUATERNARY AMMONIUM SALT ANTISTATIC AGENT EASTMAN CHEMICAL COMPANY 2002-09-24 US disclosed
EP-1165679-A2 COPOLYESTERS WITH ANTISTATIC PROPERTIES AND HIGH CLARITY EASTMAN CHEMICAL COMPANY (US) 2002-01-02 EP disclosed
EP-1155075-A1 SINGLE SCREW EXTRUSION OF POLYMERS EASTMAN CHEMICAL COMPANY (US) 2001-11-21 EP disclosed
US-5053531-A For use on synthetic polymer articles PPG INDUSTRIES, INC. (US) 1991-10-01 US disclosed
US-5053531-A For use on synthetic polymer articles PPG INDUSTRIES, INC. (US) 1991-10-01 US disclosed
EP-0442948-A1 QUATERNARY AMMONIUM ANTISTATIC COMPOUNDS PPG INDUSTRIES, INC. (US) 1991-08-28 EP disclosed
WO-1990005129-A2 QUATERNARY AMMONIUM ANTISTATIC COMPOUNDS PPG INDUSTRIES, INC. (US) 1990-05-17 WO disclosed
US-4904825-A SALTS OF ALKYLBENZENE OR ALKANE SULFONATES; HEAT RESISTANCE; DECAY; POLYMER NONCONDUCTORS; TEXTILES; FIBERS PPG INDUSTRIES, INC. (US) 1990-02-27 US disclosed
US-4904825-A SALTS OF ALKYLBENZENE OR ALKANE SULFONATES; HEAT RESISTANCE; DECAY; POLYMER NONCONDUCTORS; TEXTILES; FIBERS PPG INDUSTRIES, INC. (US) 1990-02-27 US disclosed