SCHEMBL2354072

SCHEMBL2354072

O=C(O)[C@H](CCS)NC1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 7/20 0.44
▸ GAA P10253 1/20 0.44
▸ CA12 O43570 3/20 0.42
▸ CA1 P00915 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ CA9 Q16790 3/20 0.42

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
SCHEMBL28135999 1.00 PYGB (0.44) PYGBGAACA12CA1CA2
SCHEMBL8898692 0.88 PYGB (0.46) PYGBGAACA12CA1CA2
SCHEMBL7048684 0.86 PYGB (0.49) PYGBGAACA12CA1CA2
SCHEMBL31206883 0.85 PYGB (0.46) PYGBGAACA12CA1CA2
SCHEMBL29550937 0.84 PYGB (0.49) PYGBGAACA12CA1CA2
SCHEMBL28732847 0.84 PYGB (0.48) PYGBGAACA12CA1CA2
SCHEMBL3801496 0.83 PYGB (0.51) PYGBGAACA12CA1CA2
SCHEMBL20476841 0.83 PYGB (0.51) PYGBGAACA12CA1CA2
SCHEMBL28419458 0.83 PYGB (0.51) PYGBGAACA12CA1CA2
SCHEMBL2012475 0.83 PYGB (0.51) PYGBGAACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119736225-A Genetically engineered bacterium for efficiently synthesizing melatonin as well as preparation method and application thereof 上海锐康生物技术研发有限公司 2025-04-01 — — CN claimed
WO-2022168650-A1 HOMOCYSTEINE DERIVATIVE AND METHOD FOR PRODUCING SAME, COMPOSITION, AND ANTI-INFLAMMATORY AGENT 長瀬産業株式会社 2022-08-11 — — WO claimed
CN-106834328-A A kind of S ribosylhomocysteines lyase gene recombinant expression carrier and its expression and application 昆明理工大学 2017-06-13 — — CN claimed
EP-1282415-A2 COMPOUNDS AND METHODS FOR REGULATING BACTERIAL GROWTH AND PATHOGENESIS Princeton University Office of Techology Licensing & I.P. (US) 2003-02-12 — — EP claimed
WO-2001085664-A2 COMPOUNDS AND METHODS FOR REGULATING BACTERIAL GROWTH AND PATHOGENESIS PRINCETON UNIVERSITY (US) 2001-11-15 — — WO claimed
CN-119736225-A Genetically engineered bacterium for efficiently synthesizing melatonin as well as preparation method and application thereof 上海锐康生物技术研发有限公司 2025-04-01 — — CN disclosed
CN-119736225-A Genetically engineered bacterium for efficiently synthesizing melatonin as well as preparation method and application thereof 上海锐康生物技术研发有限公司 2025-04-01 — — CN disclosed
CN-117740961-A Compound analysis method of liquorice and liquorice probiotics fermentation preparation 北京中医药大学 2024-03-22 — — CN disclosed
CN-117045661-B Application of SAHH reversible inhibitor, pharmaceutical composition and application thereof 广东医科大学附属医院 2024-01-30 — — CN disclosed
CN-117045661-A Application of SAHH reversible inhibitor, pharmaceutical composition and application thereof 广东医科大学附属医院 2023-11-14 — — CN disclosed
WO-2022168650-A1 HOMOCYSTEINE DERIVATIVE AND METHOD FOR PRODUCING SAME, COMPOSITION, AND ANTI-INFLAMMATORY AGENT 長瀬産業株式会社 2022-08-11 — — WO disclosed
CN-110325545-A Attenuated bacteria-based protein delivery 巴塞尔大学 2019-10-11 — — CN disclosed
EP-1417225-A2 CRYSTALS AND STRUCTURE OF LUXS Structural Genomix, Inc. (US) 2004-05-12 — — EP disclosed
WO-2003066880-A2 METHOD FOR ACCESSING MICROBIAL DIVERSITY FRAUNHOFER USA INC. (US) 2003-08-14 — — WO disclosed
WO-2003018046-A1 CRYSTALS OF LUXP AND COMPLEXES THEREOF QUOREX PHARMACEUTICALS, INC. (US) 2003-03-06 — — WO disclosed
EP-1282415-A2 COMPOUNDS AND METHODS FOR REGULATING BACTERIAL GROWTH AND PATHOGENESIS Princeton University Office of Techology Licensing & I.P. (US) 2003-02-12 — — EP disclosed
WO-2002038595-A2 CRYSTALS AND STRUCTURE OF LUXS STRUCTURAL GENOMIX, INC. (US) 2002-05-16 — — WO disclosed
WO-2001085664-A2 COMPOUNDS AND METHODS FOR REGULATING BACTERIAL GROWTH AND PATHOGENESIS PRINCETON UNIVERSITY (US) 2001-11-15 — — WO disclosed
EP-1135144-A1 COMPOSITIONS AND METHODS FOR REGULATING BACTERIAL PATHOGENESIS Princeton University (US) 2001-09-26 — — EP disclosed
WO-2000032152-A2 COMPOSITIONS AND METHODS FOR REGULATING BACTERIAL PATHOGENESIS PRINCETON UNIVERSITY (US) 2000-06-08 — — WO disclosed
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