SCHEMBL1908562

SCHEMBL1908562

COP(=O)(OC)OC(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.48
CTSA P10619 1/20 0.48
ALOX15 P16050 2/20 0.36
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
BCHE P06276 1/20 0.33
HIF1A Q16665 1/20 0.33
MAPT P10636 1/20 0.31

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
SCHEMBL3820524 0.94 ACHE (0.48) ACHECTSAALOX15ALDH1A1L3MBTL1
SCHEMBL7546836 0.86 ACHE (0.42) ACHECTSAALOX15ALDH1A1L3MBTL1
SCHEMBL12503683 0.84 ACHE (0.40) ACHECTSAALOX15ALDH1A1L3MBTL1
SCHEMBL80155 0.83 CTSA (0.56) ACHECTSAALDH1A1L3MBTL1KDM4E
SCHEMBL14748694 0.81 ALOX15 (0.36) ACHECTSAALOX15ALDH1A1LMNA
SCHEMBL28848779 0.80 TSHR (0.52) ACHECTSAALDH1A1KDM4EPOLB
SCHEMBL3628442 0.78 CTSA (0.50) ACHECTSAALDH1A1L3MBTL1KDM4E
SCHEMBL23005635 0.77 ALOX15 (0.34) ACHECTSAALOX15ALDH1A1LMNA
SCHEMBL14899309 0.77 ALOX15 (0.34) ACHECTSAALOX15ALDH1A1LMNA
SCHEMBL28637397 0.77 LMNA (0.36) ACHECTSAALOX15ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023156652-A1 ANTISENSE OLIGONUCLEOTIDE F. HOFFMANN-LA ROCHE AG (CH) 2023-08-24 WO disclosed
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
US-9540312-B2 Non-flammable electrolyte composition including carbonate-terminated perfluoropolymer and phosphate-terminated or phosphonate-terminated perfluoropolymer and battery using same Blue Current, Inc. (US) 2017-01-10 US disclosed
US-9543619-B2 Functionalized phosphorus containing fluoropolymers and electrolyte compositions Blue Current, Inc. (US) 2017-01-10 US disclosed
US-20160333024-A1 OXABICYCLOHEPTANE PRODRUGS LIXTE BIOTECHNOLOGY, INC. (US) 2016-11-17 US disclosed
US-20160226104-A1 FUNCTIONALIZED PHOSPHORUS CONTAINING FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS Blue Current, Inc. 2016-08-04 US disclosed
US-20160226103-A1 FUNCTIONALIZED FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS Blue Current, Inc. 2016-08-04 US disclosed
US-20160226102-A1 FUNCTIONALIZED FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS Blue Current, Inc. 2016-08-04 US disclosed
US-20160221926-A1 FUNCTIONALIZED FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS Blue Current, Inc. 2016-08-04 US disclosed
US-20160226101-A1 FUNCTIONALIZED FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS Blue Current, Inc. 2016-08-04 US disclosed
US-9296703-B2 Substituted N-(3-(pyrimidin-4-yl)phenyl)acrylamide analogs as tyrosine receptor kinase BTK inhibitors UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-03-29 US disclosed
US-20150368208-A1 Substituted N-(3-(Pyrimidin-4-YL)Phenyl)Acrylamide Analogs as Tyrosine Receptor Kinase BTK Inhibitors UNIVERSITY OF UTAH 2015-12-24 US disclosed
US-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2014-06-19 US disclosed
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2012-02-02 US 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 (5 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-20160221926-A1 FUNCTIONALIZED FLUOROPOLYMERS AND ELECTROLYTE COMPOSITIONS PEF1, PFAS, PFKFB3 ACHE 4089/4885CTSA 3838/4885ALOX15 2853/4885
US-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY ACHE 815/4885CTSA 1869/4885ALOX15 1133/4885
US-20150368208-A1 Substituted N-(3-(Pyrimidin-4-YL)Phenyl)Acrylamide Analogs as Tyrosine Receptor Kinase BTK Inhibitors BTK, SYK, LYN ACHE 3792/4885CTSA 3591/4885ALOX15 3551/4885
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY ACHE 815/4885CTSA 1869/4885ALOX15 1133/4885
US-20160333024-A1 OXABICYCLOHEPTANE PRODRUGS UGT2B7, UGT1A6, UGT1A1 ACHE 1571/4885CTSA 3774/4885ALOX15 2599/4885

“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.