SCHEMBL26912110

SCHEMBL26912110

CC(=O)OCC(=O)NCc1[nH]c2c(Cl)c(Cl)cc(N)c2c1-c1cn[nH]c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 2/20 0.35
▸ HPGD P15428 4/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ ROCK2 O75116 11/20 0.33
▸ ROCK1 Q13464 11/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ DYRK1A Q13627 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 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
SCHEMBL26913459 0.78 CGAS (0.39) CGASROCK2ROCK1
SCHEMBL26913021 0.78 CGAS (0.41) CGASROCK2ROCK1
SCHEMBL26912246 0.76 CGAS (0.41) CGASROCK2ROCK1
SCHEMBL26912789 0.76 CGAS (0.40) CGASROCK2ROCK1
Hydrochloric Acid SCHEMBL26912444 0.75 CGAS (0.37) CGASROCK2ROCK1
Hydrochloric Acid SCHEMBL26913350 0.75 CGAS (0.37) CGASROCK2ROCK1
SCHEMBL26912593 0.73 CGAS (0.40) CGASROCK2ROCK1
SCHEMBL26912976 0.71 CGAS (0.40) CGASROCK2ROCK1
SCHEMBL26913417 0.71 ROCK2 (0.37) ROCK2ROCK1
SCHEMBL26912305 0.70 ROCK2 (0.38) ROCK2ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023235809-A1 CGAS INHIBITORS ELI LILLY AND COMPANY (US) 2023-12-07 — — WO disclosed
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 1/4885HPGD 1300/4885MAPK1 1900/4885

“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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