SCHEMBL3040262

SCHEMBL3040262

C=C(CCC(C)CN=C=O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 3/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
GRM1 Q13255 1/20 0.32
GRM2 Q14416 1/20 0.32

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
SCHEMBL4447284 0.75 TET2 (0.31) TET2TET3TET1GRIK1GRIK2
SCHEMBL3234240 0.74 TRPA1 (0.31)
SCHEMBL9857356 0.74 TET2 (0.33) TET2TET3TET1
SCHEMBL3880567 0.74 TSHR (0.41) TET2TET3TET1GRIK1GRIK2
SCHEMBL2808088 0.74 TET2 (0.35) TET2TET3TET1GRIK1GRIK2
SCHEMBL10709816 0.72
SCHEMBL23494224 0.72 RNPEP (0.35) TET2TET3TET1GRIK1GRIK2
SCHEMBL439461 0.72 TSHR (0.39) TET2TET3TET1GRIK1GRIK2
SCHEMBL7361579 0.71 BHMT (0.35)
SCHEMBL346413 0.71 TET2 (0.37) TET2TET3TET1GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100210812-A1 CURABLE COMPOSITION AND CURED PRODUCT THEREOF SHOWA DENKO K.K. (JP) 2010-08-19 US disclosed
US-20100087611-A1 URETHANE COMPOUND, CURABLE COMPOSITION CONTAINING THE SAME, AND CURED PRODUCT THEREOF SHOWA DENKO K.K. (JP) 2010-04-08 US disclosed
US-4774178-A Immobilization of biological material within a polymer matrix BAYER AKTIENGESELLSCHAFT (DE) 1988-09-27 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 (1 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-20100087611-A1 URETHANE COMPOUND, CURABLE COMPOSITION CONTAINING THE SAME, AND CURED PRODUCT THEREOF ITCH, GLI1, UNC119 TET2 539/4885TET3 242/4885TET1 199/4885

“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.