Glycerin

Glycerin

SCHEMBL8079924

C=CCOCC=C.O=S(=O)(O)O.OCC(O)CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Glycerin. 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
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
CA7 P43166 4/20 0.44
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CA9 Q16790 4/20 0.37
CA4 P22748 3/20 0.37

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
Glycerin SCHEMBL93296 0.89 CA1 (0.52) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL9617071 0.89 CA1 (0.52) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL748344 0.89 CA1 (0.52) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL525782 0.89 CA1 (0.52) CA1CA2CA7ALDH1A1LMNA
Sulfuric Acid SCHEMBL952926 0.88 CA1 (0.55) CA1CA2CA7CA9CA4
Glycerin SCHEMBL27478437 0.88 CA1 (0.41) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL5925037 0.87 CA1 (0.50) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL7868615 0.87 CA1 (0.50) CA1CA2CA7ALDH1A1LMNA
Glycerin SCHEMBL5924822 0.87 CA1 (0.50) CA1CA2CA7ALDH1A1LMNA
Sulfuric Acid SCHEMBL9475257 0.86 CA1 (0.53) CA1CA2CA7CA9CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6156721-A Use of anionic gemini tensides in formulations for washing, cleaning and body care agents RWE-DEA AKTIENGESELLSCHAFT FUER MINERALOEL UND CHEMIE (DE) 2000-12-05 US claimed
EP-0915945-B1 FORMULATIONS FOR WASHING, CLEANING AND BODY CARE AGENTS COMPRISING ANIONIC GEMINI SURFACTANTS AND THEIR USE RWE DEA AG (DE) 2000-10-11 EP claimed
CN-1093877-C Use of anionic gemini tensides in formulations for washing, cleaning and body care agents RWE DEA PETROCHEMICAL CO LTD (DE) 2002-11-06 CN disclosed
US-6156721-A Use of anionic gemini tensides in formulations for washing, cleaning and body care agents RWE-DEA AKTIENGESELLSCHAFT FUER MINERALOEL UND CHEMIE (DE) 2000-12-05 US disclosed
US-6034271-A Betaine gemini surfactants made from amines HUELS AKTIENGESELLSCHAFT (DE) 2000-03-07 US disclosed
CN-1222932-A Use of anionic gemini surfactants in formulations of detergents, cleaning agents and skin-care agents RWE DEA PETROCHEMICAL CO LTD (DE) 1999-07-14 CN disclosed
CN-1173127-A Shelf stable skin cleansing liquid compositions containing gel forming polymers and lipids PROCTER & GAMBLE (US) 1998-02-11 CN disclosed