SCHEMBL1704918

SCHEMBL1704918

CSCCC=C(C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.42
CD81 P60033 2/20 0.38
ALDH1A1 P00352 1/20 0.37
RNPEP Q9H4A4 1/20 0.34
PPARG P37231 1/20 0.33
BACE1 P56817 1/20 0.32
PTGS1 P23219 1/20 0.30
AKR1C3 P42330 1/20 0.30
TBXAS1 P24557 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
SCHEMBL1704915 1.00 TDP1 (0.42) TDP1CD81ALDH1A1RNPEPPPARG
SCHEMBL9407669 0.84 CD81 (0.39) TDP1CD81PPARGBACE1PTGS1
SCHEMBL22528431 0.82 CD81 (0.38) TDP1CD81PPARGBACE1PTGS1
SCHEMBL1765494 0.80 CD81 (0.44) CD81PPARGBACE1PTGS1AKR1C3
SCHEMBL129059 0.80 CD81 (0.44) CD81PPARGBACE1PTGS1AKR1C3
SCHEMBL2523050 0.78 TSHR (0.42) CD81PPARGBACE1PTGS1
SCHEMBL4276702 0.78 TSHR (0.42) CD81PPARGBACE1PTGS1
SCHEMBL8999408 0.77 TDP1 (0.37) TDP1
SCHEMBL9983159 0.77 TDP1 (0.40) TDP1CD81PPARGBACE1PTGS1
SCHEMBL9571096 0.77 CD81 (0.35) CD81PPARGBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3368593-B1 IMPROVED BINDER COMPOSITIONS AND USES THEREOF KNAUF INSULATION SPRL (BE) 2023-12-06 EP claimed
EP-2961762-B1 MIXED-MODE CHROMATOGRAPHY MEMBRANES MERCK MILLIPORE LTD (IE) 2022-04-06 EP claimed
WO-2019034597-A1 FORCE-RESPONSIVE POLYMERSOMES AND NANOREACTORS; PROCESSES UTILIZING THE SAME ADOLPHE MERKLE INSTITUTE, UNIVERSITY OF FRIBOURG (CH) 2019-02-21 WO claimed
US-4404184-A Flavoring with methyl-thio-2-methyl-2-pentenoate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-09-13 US claimed
US-4400390-A TASTE AND FLAVOR ENHANCERS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-08-23 US claimed
US-4379079-A Use of methyl-thio-2-methyl-2-pentenoate in augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-04-05 US claimed
EP-4214277-A1 SULFIDE-CONTAINING STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-YNE COMPOSITIONS Bruno Bock GmbH (DE) 2023-07-26 EP disclosed
CN-113795153-A Methods and compositions for improving the taste of sugarless cola soda water and other beverages 格雷戈里·阿哈罗尼安 2021-12-14 CN disclosed
WO-2019034597-A1 FORCE-RESPONSIVE POLYMERSOMES AND NANOREACTORS; PROCESSES UTILIZING THE SAME ADOLPHE MERKLE INSTITUTE, UNIVERSITY OF FRIBOURG (CH) 2019-02-21 WO disclosed
EP-2440326-B1 POLYSACCHARIDE MATRIX HAVING A GRAFTED POLYMER, METHOD FOR PRODUCING THE SAME AND USE THEREOF SARTORIUS STEDIM BIOTECH GMBH (DE) 2017-10-04 EP disclosed
US-9238715-B2 Polymerizable composition for ophthalmic and medical use and antimicrobial composition obtained by polymerizing the polymerizable composition NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-01-19 US disclosed
EP-2753472-B1 METHOD FOR INCREASING THE COUNTERFEIT PROTECTION FOR AN ARTICLE DURST PHOTOTECH DIGITAL TECH (AT) 2016-01-06 EP disclosed
US-20140163133-A1 POLYMERIZABLE COMPOSITION FOR OPHTHALMIC AND MEDICAL USE AND ANTIMICROBIAL COMPOSITION OBTAINED BY POLYMERIZING THE POLYMERIZABLE COMPOSITION MENICON CO., LTD (JP) 2014-06-12 US disclosed
US-4404184-A Flavoring with methyl-thio-2-methyl-2-pentenoate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-09-13 US disclosed
US-4400390-A TASTE AND FLAVOR ENHANCERS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-08-23 US disclosed
US-4400390-A TASTE AND FLAVOR ENHANCERS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-08-23 US disclosed
US-4400390-A TASTE AND FLAVOR ENHANCERS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-08-23 US disclosed
US-4379079-A Use of methyl-thio-2-methyl-2-pentenoate in augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-04-05 US disclosed
US-4379079-A Use of methyl-thio-2-methyl-2-pentenoate in augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-04-05 US disclosed
US-4379079-A Use of methyl-thio-2-methyl-2-pentenoate in augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-04-05 US disclosed