SCHEMBL26912854

SCHEMBL26912854

OCCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 3/20 0.39
▸ AKT1 P31749 1/20 0.37
▸ ROCK2 O75116 12/20 0.34
▸ ROCK1 Q13464 11/20 0.34
▸ CDC42BPB Q9Y5S2 3/20 0.32
▸ PIM1 P11309 2/20 0.32
▸ CDC7 O00311 1/20 0.32
▸ MAP4K4 O95819 1/20 0.32
▸ PRKACA P17612 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ HIPK2 Q9H2X6 1/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.32
▸ CDC42BPA Q5VT25 2/20 0.32
▸ LRRK2 Q5S007 2/20 0.32
▸ STK4 Q13043 1/20 0.31
▸ STK3 Q13188 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ PIM2 Q9P1W9 1/20 0.31
▸ TDO2 P48775 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
SCHEMBL26912568 0.93 STK3 (0.39) CGASAKT1ROCK2ROCK1CDC42BPB
SCHEMBL26912394 0.88 CGAS (0.35) CGASAKT1ROCK2ROCK1CDC42BPB
SCHEMBL26913366 0.86 CGAS (0.36) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912804 0.86 PGK1 (0.40) CGASROCK2ROCK1CDC42BPBPIM1
SCHEMBL26912327 0.85 CGAS (0.38) CGASAKT1ROCK2ROCK1CDC42BPB
SCHEMBL26912265 0.84 CGAS (0.37) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912735 0.84 CGAS (0.37) CGASAKT1ROCK2ROCK1
SCHEMBL26912150 0.84 CGAS (0.36) CGASAKT1ROCK2ROCK1LRRK2
SCHEMBL26912763 0.83 CGAS (0.39) CGASROCK2ROCK1TDO2
SCHEMBL26912685 0.83 CGAS (0.35) CGASROCK2ROCK1CDC42BPBPIM1

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 1/4885AKT1 1311/4885ROCK2 878/4885

“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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