SCHEMBL818254

SCHEMBL818254

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.36
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
SLC7A5 Q01650 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
SCHEMBL2983914 0.79 LMNA (0.39) LMNACYP2C19CA12CA1CA2
SCHEMBL1877202 0.77 TP53 (0.35) TP53CA12CA1CA2MMP1
SCHEMBL2978531 0.77 SMN1; SMN2 (0.41) LMNACYP2C19CA12CA1CA2
SCHEMBL7620707 0.77 LMNA (0.38) LMNACYP2C19CA12CA1CA2
SCHEMBL6473670 0.77 LMNA (0.38) LMNACYP2C19CA12CA1CA2
SCHEMBL24801628 0.77 TP53 (0.35) TP53
SCHEMBL15970677 0.77 CTSA (0.40) LMNACYP2C19TP53TDP1
SCHEMBL2991395 0.75 TP53 (0.33) TP53CA12CA1CA2MMP1
SCHEMBL8644884 0.74 LMNA (0.44) LMNACYP2C19TP53TDP1SLC1A3
SCHEMBL11268072 0.73 CYP2C19 (0.32) LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2882030-B1 NON-AQUEOUS ELECTROLYTE AND ENERGY STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2017-06-21 EP claimed
CN-115197160-A Heterocyclic compounds 武田药品工业株式会社 2022-10-18 CN disclosed
CN-107108506-B Heterocyclic compounds 武田药品工业株式会社 2022-06-21 CN disclosed
CN-109415384-B Fused heterocyclic compound 武田药品工业株式会社 2022-01-11 CN disclosed
CN-107848971-B Heterocyclic compounds 武田药品工业株式会社 2021-03-26 CN disclosed
CN-108026088-B Oxadiazole derivatives as HDAC inhibitors 武田药品工业株式会社 2021-02-12 CN disclosed
CN-108431004-B Heterocyclic compounds 武田药品工业株式会社 2021-02-12 CN disclosed
CN-107207444-B Bicyclic compounds 武田药品工业株式会社 2020-07-24 CN disclosed
WO-2020069055-A1 TRANSTHYRETIN (TTR) IRNA COMPOSITIONS AND METHODS OF USE THEREOF FOR TREATING OR PREVENTING TTR-ASSOCIATED OCULAR DISEASES ALNYLAM PHARMACEUTICALS, INC. (US) 2020-04-02 WO disclosed
WO-2018029699-A1 SOLID STATE FORMS OF (2E)-N-HYDROXY-3-[3-(PHENYLSULFAMOYL)PHENYL]PROP-2-ENAMIDE AND PROCESS FOR PREPARATION THEREOF MSN RESEARCH & DEVELOPMENT CENTER (IN) 2018-02-15 WO disclosed
EP-2287157-A1 METHOD FOR OBTAINING CINATRINS C3 AND C1 Consejo Superior de Investigaciones Cientificas (ES) 2011-02-23 EP disclosed
WO-2010026214-A1 PYRAZOLOPYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 WO disclosed
US-7579487-B2 Process for making N-sulfonated-amino acid derivatives MERCK & CO., INC. (US) 2009-08-25 US disclosed
US-20070219382-A1 Process For Making N-Sulfonated-Amino Acid Derivatives MERCK SHARP & DOHME CORP. 2007-09-20 US disclosed
US-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-25 US disclosed
US-4591651-A Process for directly converting an aldehyde into an ethylene ester AGRIFURANE S.A. (FR) 1986-05-27 US disclosed
US-4338458-A Cyclopentane derivatives useful as perfuming agents FIRMENICH SA (CH) 1982-07-06 US disclosed
EP-0000833-B1 DERIVATIVES OF PHOSPHONOACYL PROLINES AND THEIR PHARMACEUTICAL USE E.R. Squibb & Sons, Inc. (US) 1981-09-02 EP disclosed
US-4151172-A Phosphonoacyl prolines and related compounds E. R. SQUIBB & SONS, INC. (US) 1979-04-24 US disclosed
EP-0000833-A1 Derivatives of phosphonoacyl prolines and their pharmaceutical use E.R. Squibb & Sons, Inc. (US) 1979-02-21 EP 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 (2 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-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof GPR119, ACOX1, ALK LMNA 1867/4885CYP2C19 744/4885TP53 4164/4885
US-20070219382-A1 Process For Making N-Sulfonated-Amino Acid Derivatives ANTXR2, STS, ASNS LMNA 1930/4885CYP2C19 2175/4885TP53 3556/4885

“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.