SCHEMBL4020730

SCHEMBL4020730

CC(C)OC(=O)CC(C(=O)OC(C)C)S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.41
LMNA P02545 2/20 0.37
TSHR P16473 2/20 0.35
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
PRKCA P17252 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 2/20 0.30
AGTR1 P30556 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL8526917 0.98 RECQL (0.40) RECQLLMNATSHRMMP1MMP2
SCHEMBL9225353 0.87 RECQL (0.38) RECQLLMNATSHRMMP1MMP2
SCHEMBL8414912 0.86 MMP1 (0.40) RECQLLMNATSHRMMP1MMP2
SCHEMBL6692606 0.84 TSHR (0.34) RECQLLMNATSHRCA12CA1
SCHEMBL8526920 0.83 LMNA (0.34) LMNATSHRMMP1MMP2MMP3
Ammonia Solution, Strong SCHEMBL9225347 0.82 TSHR (0.33) RECQLLMNATSHRCA12CA1
SCHEMBL1257844 0.81 RECQL (0.39) RECQLMMP1MMP2MMP3MMP9
SCHEMBL11515087 0.80 CA12 (0.34) LMNATSHRCA12CA1CA2
SCHEMBL6128366 0.79 RECQL (0.44) RECQLMMP1MMP2MMP3MMP9
SCHEMBL1221451 0.79 CYP19A1 (0.38) RECQLMMP1MMP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004108414-A2 LITHOGRAPHIC PRINTING PLATE SYSTEM AND METHOD FOR MANUFACTURING THE PLATE SYSTEM DIGITAL MIND S.R.L. (IT) 2004-12-16 WO claimed
US-4448932-A Polyvinyl chloride modified with butadiene-containing core-shell composite polymers for enhanced impact strength GAF CORPORATION (US) 1984-05-15 US claimed
US-20250134790-A1 ANTIMICROBIAL COMPOSITIONS FIRMENICH SA (CH) 2025-05-01 US disclosed
EP-4387583-A1 ANTIMICROBIAL COMPOSITIONS Firmenich SA (CH) 2024-06-26 EP disclosed
CN-117881386-A Antimicrobial compositions 弗门尼舍有限公司 2024-04-12 CN disclosed
CN-116165297-A Method for simultaneously detecting three 1, 4-butanesulfonate compounds in medicine 浙江海正药业股份有限公司 2023-05-26 CN disclosed
US-20230105693-A1 ANTIMICROBIAL COMPOSITIONS FIRMENICH SA (CH) 2023-04-06 US disclosed
WO-2023020929-A1 ANTIMICROBIAL COMPOSITIONS FIRMENICH SA (CH) 2023-02-23 WO disclosed
EP-4106718-A1 ANTIMICROBIAL COMPOSITIONS Firmenich SA (CH) 2022-12-28 EP disclosed
CN-114096235-A Antimicrobial compositions 弗门尼舍有限公司 2022-02-25 CN disclosed
US-9200098-B2 Radiation-sensitive composition and compound JSR CORPORATION (JP) 2015-12-01 US disclosed
CN-1289056-C Cosmetic compositions containing dispersion polymers ONDEO NALCO CO (US) 2006-12-13 CN disclosed
WO-2006053458-A1 BACTERICIDAL FORMULATIONS GIVAUDAN SA (CH) 2006-05-26 WO disclosed
EP-1287184-B1 SATIN-FINISHED NICKEL OR NICKEL ALLOY COATING ATOTECH DEUTSCHLAND GMBH (DE) 2006-02-01 EP disclosed
US-20050150774-A1 Contains quarternary ammonium compound and polyether with strongly hydrophobic side chain; long periods of operation or heating and cooling cycles; gloss finish; reduced sensitivity to wetting agents ATOTECH DEUTSCHLAND GMBH & CO. KG (F/K/A ATOTECH DEUTSCHLAND GMBH) (DE) 2005-07-14 US disclosed
WO-2004108414-A2 LITHOGRAPHIC PRINTING PLATE SYSTEM AND METHOD FOR MANUFACTURING THE PLATE SYSTEM DIGITAL MIND S.R.L. (IT) 2004-12-16 WO disclosed
US-20040248029-A1 Lithographic printing plate system and method for manufacturing the plate system DIGITAL MIND S.R.L. 2004-12-09 US disclosed
CN-1512867-A Cosmetic compositions containing dispersion polymers �̵°��ɶ��ƹ�˾ 2004-07-14 CN disclosed
US-4588412-A Solid formulations of dyes which are sparingly soluble or insoluble in water CIBA-GEIGY CORPORATION (US) 1986-05-13 US disclosed
US-4448932-A Polyvinyl chloride modified with butadiene-containing core-shell composite polymers for enhanced impact strength GAF CORPORATION (US) 1984-05-15 US disclosed