SCHEMBL26912433

SCHEMBL26912433

CC(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 17/20 0.40
▸ CGAS Q8N884 2/20 0.39
▸ ROCK1 Q13464 16/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ CDC42BPB Q9Y5S2 1/20 0.34

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
SCHEMBL26912510 0.88 CGAS (0.35) ROCK2CGASROCK1IRAK4CDC42BPB
SCHEMBL26913323 0.86 CGAS (0.44) ROCK2CGASROCK1IRAK4
SCHEMBL26913748 0.86 USP2 (0.43) ROCK2CGASROCK1
SCHEMBL26912243 0.85 CGAS (0.39) ROCK2CGASROCK1IRAK4
SCHEMBL26913242 0.85 CGAS (0.38) ROCK2CGASROCK1IRAK4
SCHEMBL26912644 0.83 CGAS (0.40) ROCK2CGASROCK1
SCHEMBL26912984 0.83 CGAS (0.40) ROCK2CGASROCK1
SCHEMBL26912804 0.81 PGK1 (0.40) ROCK2CGASROCK1CDC42BPB
Hydrochloric Acid SCHEMBL26913201 0.81 CGAS (0.36) ROCK2CGASROCK1CDC42BPB
SCHEMBL26912763 0.81 CGAS (0.39) ROCK2CGASROCK1

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 ROCK2 878/4885CGAS 1/4885ROCK1 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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