SCHEMBL254386

SCHEMBL254386

CC(=O)O[C@@H]1C=C[C@H](OC(C)=O)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.42
CA9 Q16790 4/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.35
POLB P06746 1/20 0.34
CHRM2 P08172 6/20 0.34
CHRM4 P08173 4/20 0.34
CHRM1 P11229 4/20 0.34
CHRM3 P20309 4/20 0.34
CHRM5 P08912 2/20 0.34
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL2290500 1.00 CA12 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL11548379 1.00 CA12 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL11746006 1.00 CA12 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL11548381 1.00 CA12 (0.42) CA12CA9CA1CA2TSHR
SCHEMBL19464089 0.91 CA12 (0.38) CA12CA9CA1CA2TSHR
SCHEMBL6561491 0.89 CA12 (0.37) CA12CA9CA1CA2TSHR
SCHEMBL8490943 0.89 CA12 (0.43) CA12CA9CA1CA2TSHR
SCHEMBL11835924 0.87 CA12 (0.40) CA12CA9CA1CA2TSHR
SCHEMBL11835919 0.87 CA12 (0.40) CA12CA9CA1CA2TSHR
SCHEMBL9600313 0.87 CA12 (0.40) CA12CA9CA1CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012063126-A2 IMPROVED PROCESSES FOR PREPARING PURE (3AR,4S,6R,6AS)-6-AMINO-2,2-DIMETHYLTETRAHDRO-3AH-CYCLOPENTA[D] [1,3]-DIOXOL-4-OL AND ITS KEY STARTING MATERIAL ACTAVIS GROUP PTC EHF (IS) 2012-05-18 WO claimed
EP-1428888-B1 Method for the production of (1S,4R)-(-)-4-Hydroxycyclopent-2-enyl esters ARCHIMICA GMBH (DE) 2008-10-22 EP claimed
US-20040126855-A1 Method for the production of (1S, 4R)-(-)-4-hydroxy cyclopent-2-enyl esters CLARIANT GMBH 2004-07-01 US claimed
EP-1428888-A1 Method for the production of (1S,4R)-(-)-4-Hydroxycyclopent-2-enyl esters Clariant GmbH (DE) 2004-06-16 EP claimed
EP-0249859-A2 Process for the preparation of (1R,4S)-4-hydroxy-2-cyclopentenyl esters BAYER AG (DE) 1987-12-23 EP claimed
EP-0167759-A1 Process for the preparation of (1S,4R)-4-hydroxy-2-cyclopentenyl esters BAYER AG (DE) 1986-01-15 EP claimed
JP-51115460-A None JP disclosed
EP-4015005-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ModernaTX, Inc. (US) 2022-06-22 EP disclosed
EP-3682905-B1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX INC (US) 2021-12-01 EP disclosed
US-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. 2021-10-07 US disclosed
US-20210299278-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF BIOLOGICS AND PROTEINS ASSOCIATED WITH HUMAN DISEASE MODERNATX, INC. 2021-09-30 US disclosed
US-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF PARABILIS MEDICINES, INC. 2021-06-17 US disclosed
EP-2922859-B1 PHOSPHONUCLEOSIDES USEFUL IN THE TREATMENT OF VIRAL DISORDERS UNIV CORK (IE) 2021-05-05 EP disclosed
WO-1993005146-A1 MOLECULES WITH ANTIBODY COMBINING SITES THAT INDUCE ASYMMETRY THE SCRIPPS RESEARCH INSTITUTE (US) 1993-03-18 WO disclosed
US-5032523-A Preparation of optically active esters LION CORPORATION (JP) 1991-07-16 US disclosed
US-4873360-A Process for the preparation of cyclopentanoids and novel intermediates produced thereby BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) 1989-10-10 US disclosed
EP-0249859-A2 Process for the preparation of (1R,4S)-4-hydroxy-2-cyclopentenyl esters BAYER AG (DE) 1987-12-23 EP disclosed
US-4008125-A New cyclopentene-diols and new acyl esters thereof and process for their preparation TEIJIN LIMITED (JA) 1977-02-15 US disclosed
US-4001308-A REACTION OF DIBROMO COMPOUND WITH METAL SALT OF ACETIC ACID TEIJIN LIMITED (JA) 1977-01-04 US disclosed
JP-S51115460-A METHOD FOR PREPARING 2-OXABICYCLO-(3.3.0)-OCT-B-ENE-3-ONE TAKANO SEIICHI 1976-10-12 JP 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 (3 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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 CA12 3297/4885CA9 2016/4885CA1 4691/4885
US-20210299278-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF BIOLOGICS AND PROTEINS ASSOCIATED WITH HUMAN DISEASE POLRMT, POLN, POLM CA12 4387/4885CA9 4572/4885CA1 4864/4885
US-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF IAPP, VIP, NGLY1 CA12 1171/4885CA9 2094/4885CA1 995/4885

“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.