SCHEMBL800569

SCHEMBL800569

CC/C=C(/C(=O)O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 3/20 0.42
GRIK2 Q13002 2/20 0.42
EP300 Q09472 1/20 0.32
GABRR1 P24046 1/20 0.32
FFAR3 O14843 1/20 0.32
TP53 P04637 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA5 P08648 1/20 0.30
ABAT P80404 1/20 0.30

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
SCHEMBL3897511 1.00 GRIK1 (0.42) GRIK1GRIK2EP300GABRR1FFAR3
SCHEMBL28162706 0.85 GRIK1 (0.44) GRIK1GRIK2EP300TP53
SCHEMBL2484517 0.85 GRIK1 (0.39) GRIK1GRIK2EP300TP53
SCHEMBL6000457 0.83 GRIK1 (0.38) GRIK1GRIK2
SCHEMBL7559349 0.83 GRIK1 (0.38) GRIK1GRIK2
SCHEMBL7564329 0.80 GRIK1 (0.46) GRIK1GRIK2EP300FFAR3
SCHEMBL7564325 0.80 GRIK1 (0.46) GRIK1GRIK2EP300FFAR3
SCHEMBL8022454 0.80 CHRM1 (0.38) GRIK1GRIK2EP300GABRR1
SCHEMBL8514553 0.80 GRIK1 (0.40) GRIK1GRIK2
SCHEMBL7171386 0.79 GABRR1 (0.32) GRIK1GABRR1TP53ITGB1ITGA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3088955-B1 RESIST COMPOSITION AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2020-06-03 EP claimed
EP-3032333-B1 SHRINK MATERIAL AND PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2017-05-24 EP claimed
EP-3032332-B1 SHRINK MATERIAL AND PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2017-04-05 EP claimed
US-20160151322-A1 METALLO-B-LACTAMASE INHIBITORS MEIJI SEIKA KAISHA (JP) 2016-06-02 US disclosed
US-9260375-B2 Metallo-β-lactamase inhibitors MEIJI SEIKA KAISHA, LTD. (JP) 2016-02-16 US disclosed
US-9115079-B2 NDM inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-08-25 US disclosed
US-20140221330-A1 NDM INHIBITOR MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-08-07 US disclosed
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS CHIKAUCHI KEN (JP) 2012-03-22 US disclosed
EP-1227111-A1 TRIPHENYLBORON-CONTAINING POLYMERS AND USE THEREOF Yoshitomi Fine Chemicals, Ltd. (JP) 2002-07-31 EP disclosed
US-4143020-A COPOLYMERS OF SULFONIC ACID MONOMERS ROHM AND HAAS COMPANY (US) 1979-03-06 US disclosed
US-4131736-A Polymers of sulfonic acid monomers ROHM AND HAAS COMPANY (US) 1978-12-26 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 (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-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS ME1, MGAM, GAA GRIK1 2255/4885GRIK2 2664/4885EP300 3934/4885
US-20140221330-A1 NDM INHIBITOR MGAM, NQO1, NQO2 GRIK1 4072/4885GRIK2 4385/4885EP300 2435/4885
US-20160151322-A1 METALLO-B-LACTAMASE INHIBITORS ME1, MGAM, MANBA GRIK1 2469/4885GRIK2 2749/4885EP300 3944/4885

“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.