SCHEMBL5633650

SCHEMBL5633650

CC(CC=O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.33

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
SCHEMBL9304034 1.00 APLNR (0.33) APLNR
SCHEMBL2160578 1.00 APLNR (0.33) APLNR
SCHEMBL9794756 0.84
SCHEMBL13619240 0.83
SCHEMBL16940575 0.81 TRPA1 (0.31)
SCHEMBL14380063 0.80
SCHEMBL4818781 0.80
SCHEMBL1804486 0.80
SCHEMBL6496533 0.80
SCHEMBL12432576 0.80

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
US-7265229-B2 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2007-09-04 US claimed
US-20060030720-A1 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2006-02-09 US claimed
US-20220409589-A1 CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY GENZYME CORP (US) 2022-12-29 US disclosed
EP-2780336-B1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN PASTEUR INSTITUT (FR) 2017-07-19 EP disclosed
US-9598393-B2 Structural variants of mycolactones for use in modulating inflammation, immunity and pain INSTITUT PASTEUR (FR) 2017-03-21 US disclosed
US-9353077-B2 Organocatalytic process for asymmetric synthesis of decanolides COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2016-05-31 US disclosed
US-20150210665-A1 ORGANOCATALYTIC PROCESS FOR ASYMMETRIC SYNTHESIS OF DECANOLIDES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-07-30 US disclosed
US-20140329771-A1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN INSTITUT PASTEUR (FR) 2014-11-06 US disclosed
EP-2594561-A1 Structural variants of mycolactones for use in modulating inflammation, immunity and pain INSTITUT PASTEUR (FR) 2013-05-22 EP disclosed
EP-2594561-A1 Structural variants of mycolactones for use in modulating inflammation, immunity and pain INSTITUT PASTEUR (FR) 2013-05-22 EP disclosed
US-7265229-B2 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2007-09-04 US disclosed
US-7265229-B2 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2007-09-04 US disclosed
US-20060030720-A1 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2006-02-09 US disclosed
US-20060030720-A1 Method for synthesizing macrosphelides LEAD CHEMICAL CO., LTD. (JP) 2006-02-09 US disclosed
WO-2004048360-A1 METHOD OF SYNTHESIZING MACROSPHELIDES LEAD CHEMICAL CO., LTD. (JP) 2004-06-10 WO disclosed
US-5332807-A Process of producing 8A- and 9A-azalide antibiotics MERCK & CO., INC. (US) 1994-07-26 US disclosed
WO-1994015617-A1 8A-AZA AND 9A-AZA MACROLIDE ANTIBIOTICS, AND A PROCESS FOR PRODUCING SAME AND METHODS OF USE MERCK & CO., INC. (US) 1994-07-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140329771-A1 STRUCTURAL VARIANTS OF MYCOLACTONES FOR USE IN MODULATING INFLAMMATION, IMMUNITY AND PAIN IL1B, MYC, IL1A APLNR 1429/4885
US-20060030720-A1 Method for synthesizing macrosphelides ADH1C, HPD, HSD17B12 APLNR 4600/4885
US-20150210665-A1 ORGANOCATALYTIC PROCESS FOR ASYMMETRIC SYNTHESIS OF DECANOLIDES CDC14A, CDC14B, DDOST APLNR 4238/4885
US-20220409589-A1 CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY CCR5, CXCR4, CXCR3 APLNR 841/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.