SCHEMBL696997

SCHEMBL696997

[CH2]COC(=O)OCC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
SLC1A3 P43003 3/20 0.39
SLC1A2 P43004 3/20 0.39
SLC1A1 P43005 3/20 0.39
ALOX5 P09917 2/20 0.37
PARP15 Q460N3 2/20 0.37
PARP10 Q53GL7 2/20 0.37
EPHX1 P07099 3/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
NAAA Q02083 1/20 0.33
MGLL Q99685 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
MIF P14174 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
SCHEMBL704782 0.98 LMNA (0.47) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL697773 0.94 LMNA (0.43) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL697012 0.90 LMNA (0.37) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL1669840 0.89 LMNA (0.59) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL23129641 0.87 LMNA (0.57) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL1672623 0.87 LMNA (0.55) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL25381860 0.83 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL698390 0.82 LMNA (0.52) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL695863 0.81 EPHX1 (0.41) LMNAEPHX1NAAAHPGD
SCHEMBL6895798 0.80 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140329868-A1 METHODS FOR TREATING HYPERTENSION TAKEDA PHARMACEUTICALS USA INC (US) 2014-11-06 US disclosed
US-8586762-B2 Process for producing fused imidazole compound, reformatsky reagent in stable form, and process for producing the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-19 US disclosed
US-20130143886-A1 METHODS FOR PRESERVING AND/OR INCREASING RENAL FUNCTION USING XANTHINE OXIDOREDUCTASE INHIBITORS TAKEDA PHARMACEUTICALS U.S.A., INC. (US) 2013-06-06 US disclosed
US-20130012553-A1 METHODS FOR STABILIZING JOINT DAMAGE IN SUBJECTS USING XANTHINE OXIDOREDUCTASE INHIBITORS TAKEDA PHARMACEUTICALS U.S.A., INC. 2013-01-10 US disclosed
US-20120077985-A1 PROCESS FOR PRODUCING FUSED IMIDAZOLE COMPOUND, REFORMATSKY REAGENT IN STABLE FORM, AND PROCESS FOR PRODUCING THE SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-29 US disclosed
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
WO-2011103439-A1 METHODS FOR STABILIZING JOINT DAMAGE IN SUBJECTS USING XANTHINE OXIDOREDUCTASE INHIBITORS TAKEDA PHARMACEUTICALS NORTH AMERICA, INC. (US) 2011-08-25 WO disclosed
EP-2320732-A2 SUBSTITUTED IMIDAZOLE COMBINATIONS Pfizer Inc. (US) 2011-05-18 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
WO-2008065408-A9 MODULATION OF PROSTAGLANDIN/CYCLOOXYGENASE METABOLIC PATHWAYS HUNTER-FLEMING LIMITED (GB) 2011-03-03 WO disclosed
EP-0521524-A1 Aminooxypyrrolidinylthiocarbapenem compounds SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1993-01-07 EP disclosed
EP-0481116-A1 A process for producing halomethylcarbapenems SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1992-04-22 EP disclosed
US-5084214-A Compounds for the treatment of artheriosclerosis SHIONOGI & CO., LTD. (JP) 1992-01-28 US disclosed
US-5064954-A Phosphorylation of hydroxymethylcarbapem and halogenation; bactericides SHIONOGI & CO., LTD. (JP) 1991-11-12 US disclosed
US-5002972-A Compound and composition of substituted hexenoic acid derivatives useful for treating thromboxane A2 mediated diseases SHIONOGI & CO., LTD. (JP) 1991-03-26 US disclosed
EP-0415566-A1 Heterocyclic compounds, processes for producing them and pharmaceutical compositions comprising them SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-03-06 EP disclosed
US-4960880-A STEREOSPECIFIC SYNTHESIS OF B-LACTAM INTERMEDIATES SHIONOGI & CO., LTD. (JP) 1990-10-02 US disclosed
EP-0384747-A1 Pharmaceutical or veterinary preparations of substituted hexenoic acid derivatives SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1990-08-29 EP disclosed
EP-0348203-A1 Phenolic thioethers, their production and use SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1989-12-27 EP disclosed
US-4731362-A Alkylcarbamoyloxymethylcephem compounds SHIONOGI & CO., LTD. (JP) 1988-03-15 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 (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-20140329868-A1 METHODS FOR TREATING HYPERTENSION XDH, REN, CYP11B2 LMNA 377/4885SLC1A3 669/4885SLC1A2 610/4885
US-20120077985-A1 PROCESS FOR PRODUCING FUSED IMIDAZOLE COMPOUND, REFORMATSKY REAGENT IN STABLE FORM, AND PROCESS FOR PRODUCING THE SAME CYP17A1, HSD17B7, HSD17B1 LMNA 4293/4885SLC1A3 4419/4885SLC1A2 4407/4885
US-20130143886-A1 METHODS FOR PRESERVING AND/OR INCREASING RENAL FUNCTION USING XANTHINE OXIDOREDUCTASE INHIBITORS XDH, GLS, REN LMNA 1663/4885SLC1A3 1956/4885SLC1A2 1921/4885
US-20130012553-A1 METHODS FOR STABILIZING JOINT DAMAGE IN SUBJECTS USING XANTHINE OXIDOREDUCTASE INHIBITORS XDH, AOX1, NQO1 LMNA 2047/4885SLC1A3 2368/4885SLC1A2 2628/4885

“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.