SCHEMBL4819461

SCHEMBL4819461

C=CCC(CCO)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
CPA1 P15085 1/20 0.37
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
FGFR4 P22455 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
SCHEMBL26088512 0.89 GRIK1 (0.47) GRIK1GRIK2CPA1CA1CA2
SCHEMBL7202052 0.86 GRIK1 (0.39) GRIK1GRIK2CPA1CA1CA2
SCHEMBL174976 0.84 GRIK1 (0.50) GRIK1GRIK2CPA1CA1CA2
SCHEMBL28012569 0.83 GRIK1 (0.42) GRIK1GRIK2CPA1CA1CA2
SCHEMBL22306014 0.81 CA1 (0.45) GRIK1GRIK2CPA1CA1CA2
SCHEMBL17343614 0.81 CA1 (0.45) GRIK1GRIK2CPA1CA1CA2
SCHEMBL8031351 0.80 GRIK1 (0.53) GRIK1GRIK2CPA1CA2TSHR
SCHEMBL10898377 0.79 GRIK1 (0.40) GRIK1GRIK2CPA1CA1CA2
SCHEMBL474901 0.78 CA2 (0.42) CA1CA2TSHR
SCHEMBL28191059 0.78 CA2 (0.62) GRIK1GRIK2CA1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365174-B2 Azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-29 US disclosed
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-22 US disclosed
EP-1661904-A1 NOVEL AZALIDE AND AZALACTAM DERIVATIVES AND PROCESS FOR THE PRODUCTION OF THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2006-05-31 EP disclosed
US-5036152-A Antiinflammatory HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-07-30 US disclosed
US-4888328-A Alkoxycarbonylalkylphospholipids and alkylaminocarbonylalkylphospholipids HOESCHST-ROUSSEL INCORPORATED (US) 1989-12-19 US disclosed
EP-0332129-A2 Alkoxy- and alkylamino-carbonylalkylphospholipids, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-13 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 (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-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same BCL6, NR4A1, NR4A2 GRIK1 993/4885GRIK2 918/4885CPA1 3605/4885

“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.