SCHEMBL2470945

SCHEMBL2470945

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

nearest known ligand 0.44

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 20)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 5/20 0.38
CHRM3 known ✓ P20309 3/20 0.38
TSHR P16473 7/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 4/20 0.40
TP53 P04637 3/20 0.40
HIF1A Q16665 3/20 0.40
CYP3A4 P08684 2/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 2/20 0.38
CHRM4 P08173 3/20 0.38
CHRM2 P08172 4/20 0.36
CYP2D6 P10635 2/20 0.36
KCNH2 Q12809 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 1/20 0.36
SCN1A P35498 2/20 0.34
SCN2A Q99250 2/20 0.34
SCN3A Q9NY46 2/20 0.34

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
SCHEMBL10881754 0.90 TSHR (0.47) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11024591 0.90 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28045898 0.88 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
Methylsulfanylmethane SCHEMBL10483613 0.88 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1598545 0.87 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5154567 0.87 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL6401478 0.87 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL304033 0.86 TSHR (0.43) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL2733907 0.86 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL27659543 0.85 CHRM5 (0.44) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054923-B1 RAPID SET LATEXES AND FOAMED ARTICLES PREPARED THEREFROM DOW GLOBAL TECHNOLOGIES INC (US) 2003-03-12 EP claimed
US-6025404-A FROTHING A LATEX THAT CONTAINS A DISPERSED POLYMER HAVING PENDANT CATIONIC GROUPS OR ADSORBING CATIONIC MOLECULES OR BOTH, AND PENDANT ACID GROUPS; AND B) RENDERING THE FROTHED LATEX SUFFICIENTLY BASIC TO MAKE THE CELLULAR ARTICLE. THE DOW CHEMICAL COMPANY (US) 2000-02-15 US claimed
CN-1043372-C Gelation of water soluble polymers PHILLIPS PETROLEUM CO (US) 1999-05-12 CN claimed
EP-0566028-B1 Gelable compositions of water soluble polymers PHILLIPS PETROLEUM CO (US) 1996-05-22 EP claimed
EP-0475325-B1 Gelatin of acrylamide-containing polymers with aminobenzoic acid compounds and water dispersible aldehydes PHILLIPS PETROLEUM CO (US) 1995-04-19 EP claimed
EP-0446865-B1 Gelation of acrylamide-containing polymers with hydroxyphenyl alkanols PHILLIPS PETROLEUM CO (US) 1994-09-21 EP claimed
EP-0447967-B1 Gelation of acrylamide-containing polymers with furfuryl alcohol and water dispersible aldehydes PHILLIPS PETROLEUM CO (US) 1994-05-18 EP claimed
EP-0566028-A1 Gelable compositions of water soluble polymers PHILLIPS PETROLEUM COMPANY (US) 1993-10-20 EP claimed
CN-1077467-A The gelation of water-soluble polymers PHILLIPS PETROLEUM CO (US) 1993-10-20 CN claimed
US-5179136-A Enhanced or recovery operations PHILLIPS PETROLEUM COMPANY (US) 1993-01-12 US claimed
US-5100931-A Crosslinking; enhanced oil recovery PHILLIPS PETROLEUM COMPANY (US) 1992-03-31 US claimed
EP-0475325-A1 Gelatin of acrylamide-containing polymers with aminobenzoic acid compounds and water dispersible aldehydes PHILLIPS PETROLEUM COMPANY (US) 1992-03-18 EP claimed
EP-0447967-A2 Gelation of acrylamide-containing polymers with furfuryl alcohol and water dispersible aldehydes PHILLIPS PETROLEUM COMPANY (US) 1991-09-25 EP claimed
EP-0446865-A2 Gelation of acrylamide-containing polymers with hydroxyphenyl alkanols PHILLIPS PETROLEUM COMPANY (US) 1991-09-18 EP claimed
US-5043364-A Adjusting permeability of well bores PHILLIPS PETROLEUM COMPANY (US) 1991-08-27 US claimed
US-5006596-A Flocculation BETZ LABORATORIES, INC. (US) 1991-04-09 US claimed
EP-0280083-B1 DELAYING THE GELATION OF WATER SOLUBLE POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1990-10-31 EP claimed
US-4822842-A WITH TRANSITION METAL IONS; ENHANCED OIL RECOVERY PHILLIPS PETROLEUM COMPANY (US) 1989-04-18 US claimed
EP-0280083-A1 Delaying the gelation of water soluble polymers PHILLIPS PETROLEUM COMPANY (US) 1988-08-31 EP claimed
US-4055502-A Method and composition for acidizing subterranean formations PHILLIPS PETROLEUM COMPANY (US) 1977-10-25 US claimed