SCHEMBL26912898

SCHEMBL26912898

CN1CCn2c(c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c32)C1=O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 1/20 0.36
▸ EZH2 Q15910 1/20 0.35
▸ GRM2 Q14416 1/20 0.31
▸ MTOR P42345 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
SCHEMBL30684437 1.00 CGAS (0.36) CGASEZH2GRM2MTOR
SCHEMBL26912442 0.89 CGAS (0.33) CGASEZH2
SCHEMBL30684432 0.89 CGAS (0.33) CGASEZH2
SCHEMBL30684344 0.86 CGAS (0.36) CGASEZH2GRM2
SCHEMBL26913300 0.86 CGAS (0.36) CGASEZH2GRM2
SCHEMBL30684384 0.84 EZH2 (0.35) EZH2GRM2
SCHEMBL26912386 0.84 EZH2 (0.35) EZH2GRM2
SCHEMBL30684252 0.81 CGAS (0.34) CGAS
SCHEMBL26912719 0.81 CGAS (0.34) CGAS
SCHEMBL26912259 0.80 CGAS (0.39) CGAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230391786-A1 cGAS INHIBITORS ELI LILLY AND COMPANY 2023-12-07 — — 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-20230391786-A1 cGAS INHIBITORS CGAS, STING1, TBK1 CGAS 1/4885EZH2 3463/4885GRM2 2645/4885

“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.

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