SCHEMBL26912246

SCHEMBL26912246

O=C(CO)NCc1[nH]c2c(Cl)c(Cl)cc(NC(=O)CO)c2c1-c1cn[nH]c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 2/20 0.41
▸ ROCK2 O75116 16/20 0.33
▸ ROCK1 Q13464 12/20 0.33
▸ JAK2 O60674 1/20 0.32
▸ IRAK4 Q9NWZ3 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 0.93 CGAS (0.39) CGASROCK2ROCK1JAK2
SCHEMBL26912976 0.81 CGAS (0.40) CGASROCK2ROCK1JAK2IRAK4
SCHEMBL26912474 0.80 ROCK2 (0.36) CGASROCK2ROCK1
SCHEMBL26912712 0.78 CGAS (0.39) CGASROCK2ROCK1JAK2IRAK4
SCHEMBL26913323 0.77 CGAS (0.44) CGASROCK2ROCK1JAK2IRAK4
SCHEMBL26912544 0.77 CGAS (0.38) CGASROCK2ROCK1IRAK4
SCHEMBL30684349 0.76 CGAS (0.39) CGASROCK2ROCK1IRAK4
SCHEMBL26913442 0.76 CGAS (0.39) CGASROCK2ROCK1IRAK4
SCHEMBL26912110 0.76 CGAS (0.35) CGASROCK2ROCK1
SCHEMBL26913157 0.74 CGAS (0.35) CGASROCK2ROCK1

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 1/4885ROCK2 878/4885ROCK1 824/4885

“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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