SCHEMBL16713448

SCHEMBL16713448

O=C(c1ccccc1)c1ccc(OCCCS(=O)(=O)O)cc1.[Na]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.62
PPARA Q07869 3/20 0.61
PKM P14618 1/20 0.54
LMNA P02545 4/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
MAPT P10636 3/20 0.54
MAPK1 P28482 1/20 0.52
LTA4H P09960 1/20 0.52
KDM4E B2RXH2 3/20 0.52
HRH4 Q9H3N8 1/20 0.52
SRD5A2 P31213 1/20 0.51
ALDH1A1 P00352 3/20 0.51
PPARG P37231 2/20 0.50
STS P08842 1/20 0.50
PPARD Q03181 1/20 0.50
HRH3 Q9Y5N1 1/20 0.48
LSS P48449 1/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL6267331 0.98 GAA (0.64) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL11496759 0.91 PPARA (0.62) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL11275464 0.91 ALDH1A1 (0.52) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL22115686 0.88 PKM (0.53) GAAPPARAPKMLMNAMAPT
SCHEMBL12659237 0.88 PKM (0.53) GAAPPARAPKMLMNAMAPT
SCHEMBL5981994 0.87 ALDH1A1 (0.56) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL16414684 0.86 PKM (0.51) GAAPPARAPKMLMNAMAPT
SCHEMBL16713447 0.84 GAA (0.60) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL11485988 0.84 PPARA (0.83) GAAPPARAPKMLMNAL3MBTL1
SCHEMBL5704316 0.84 KCNA3 (0.58) PKMLMNAL3MBTL1MAPTLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112789263-A Addition-fragmentation agents with pendant amine groups 3M创新有限公司 2021-05-11 CN claimed
CN-115443266-B Monomers, polymers and articles for biomaterial capture 舒万诺知识产权公司 2024-05-17 CN disclosed
CN-114729084-B Biotin-containing monomers and articles formed therefrom 3M创新有限公司 2023-09-15 CN disclosed
CN-115443266-A Monomers, polymers and articles for biomaterial capture 3M创新有限公司 2022-12-06 CN disclosed
CN-111511818-B Polymer substrates with attached polymer chains 3M创新有限公司 2022-10-25 CN disclosed
CN-114729084-A Biotin-containing monomers and articles formed therefrom 3M创新有限公司 2022-07-08 CN disclosed
CN-111601858-B Fluorinated elastomers cured by actinic radiation and methods thereof 3M创新有限公司 2022-06-21 CN disclosed
CN-109689189-B Functionalized copolymers and uses thereof 3M创新有限公司 2022-02-01 CN disclosed
CN-108137841-B Hydrogel compositions bonded to polymeric substrates 3M创新有限公司 2021-07-06 CN disclosed
CN-111601858-A Fluorinated elastomers cured by actinic radiation and methods thereof 3M创新有限公司 2020-08-28 CN disclosed
CN-106470654-B Absorbent article and method of making the same 3M创新有限公司 2020-08-25 CN disclosed
CN-111511818-A Polymer substrates with attached polymer chains 3M创新有限公司 2020-08-07 CN disclosed
CN-111511817-A Polymer substrates having attached thiocarbonylthio-containing groups 3M创新有限公司 2020-08-07 CN disclosed
CN-105593276-B Ligand functionalized substrates with enhanced binding capacity 3M创新有限公司 2020-03-27 CN disclosed
CN-106488779-B Absorbent article and method of making the same 3M创新有限公司 2020-02-21 CN disclosed
US-9616394-B2 Graft copolymer functionalized article 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-04-11 US disclosed
US-20150136698-A1 GRAFT COPOLYMER FUNCTIONALIZED ARTICLE SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2015-05-21 US disclosed