SCHEMBL306031

SCHEMBL306031

COC(=O)N(CC(C)C)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA9 Q16790 3/20 0.50
MLYCD O95822 1/20 0.35
LMNA P02545 2/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PIK3CD O00329 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
FPR1 P21462 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL12763774 0.89 CA12 (0.45) CA12CA1CA2CA9MLYCD
SCHEMBL24061317 0.88 CA12 (0.41) CA12CA1CA2CA9MLYCD
SCHEMBL27014703 0.87 CA1 (0.43) CA12CA1CA2CA9MLYCD
SCHEMBL15359960 0.85 CA12 (0.42) CA12CA1CA2CA9MLYCD
SCHEMBL12588890 0.83 CA1 (0.48) CA12CA1CA2CA9MLYCD
SCHEMBL10257143 0.82 KDM4C (0.40) CA12CA1CA2CA9LMNA
SCHEMBL6893955 0.79 CA12 (0.45) CA12CA1CA2CA9MLYCD
SCHEMBL6894039 0.79 CA12 (0.45) CA12CA1CA2CA9MLYCD
SCHEMBL11682685 0.78 CA1 (0.38) CA12CA1CA2CA9MEN1
SCHEMBL306030 0.78 CA1 (0.48) CA12CA1CA2CA9MLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687490-B2 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2010-03-30 US claimed
EP-1870412-A1 2-THIOETHENYL CARBAPENEM DERIVATIVE MEIJI SEIKA KAISHA LTD. (JP) 2007-12-26 EP claimed
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2007-01-04 US claimed
WO-2020153433-A1 SUBSTITUENT-INCLUDING UREA COMPOUND 第一三共株式会社 2020-07-30 WO disclosed
US-9260375-B2 Metallo-β-lactamase inhibitors MEIJI SEIKA KAISHA, LTD. (JP) 2016-02-16 US disclosed
EP-2415875-B1 METHOD FOR IDENTIFICATION OF METALLO-[BETA]-LACTAMASE-PRODUCING BACTERIUM MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-04 EP disclosed
US-8697382-B2 Method of identifying metallo-β-lactamase-producing bacteria MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-04-15 US disclosed
US-8344154-B2 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2013-01-01 US disclosed
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS CHIKAUCHI KEN (JP) 2012-03-22 US disclosed
US-20120064557-A1 METHOD OF IDENTIFYING METALLO-BETA-LACTAMASE-PRODUCING BACTERIA MEIJI SEIKA PHARMA CO., LTD. (JP) 2012-03-15 US disclosed
EP-2415875-A1 METHOD FOR IDENTIFICATION OF METALLO- B -LACTAMASE-PRODUCING BACTERIUM Meiji Seika Pharma Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20080090825-A1 Metallo-beta-lactamase inhibitors MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-17 US disclosed
EP-1870412-A1 2-THIOETHENYL CARBAPENEM DERIVATIVE MEIJI SEIKA KAISHA LTD. (JP) 2007-12-26 EP disclosed
CN-1309699-C Method and apparatus for preparing dialkyl carbonate GEN ELECTRIC (US) 2007-04-11 CN disclosed
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2007-01-04 US disclosed
CN-1678559-A Method and apparatus for preparing a dialkyl carbonate GEN ELECTRIC (US) 2005-10-05 CN disclosed
EP-1562889-A1 METHOD AND APPARATUS FOR PREPARING A DIALKYL CARBONATE GENERAL ELECTRIC COMPANY (a New York Corporation) (US) 2005-08-17 EP disclosed
EP-1419132-A1 METHOD FOR PREPARING A DIALKYL CARBONATE, AND ITS USE IN THE PREPARATION OF DIARYL CARBONATES AND POLYCARBONATES GENERAL ELECTRIC COMPANY (US) 2004-05-19 EP disclosed
WO-2004000780-A1 METHOD AND APPARATUS FOR PREPARING A DIALKYL CARBONATE GENERAL ELECTRIC COMPANY (US) 2003-12-31 WO disclosed
WO-2003016258-A1 METHOD FOR PREPARING A DIALKYL CARBONATE, AND ITS USE IN THE PREPARATION OF DIARYL CARBONATES AND POLYCARBONATES GENERAL ELECTRIC COMPANY (US) 2003-02-27 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 (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-20080090825-A1 Metallo-beta-lactamase inhibitors ME1, MGAM, GAA CA12 909/4885CA1 727/4885CA2 313/4885
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS ME1, MGAM, GAA CA12 909/4885CA1 727/4885CA2 313/4885
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MTAP, BLVRB, BPGM CA12 799/4885CA1 3160/4885CA2 1641/4885

“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.