SCHEMBL26912487

SCHEMBL26912487

FC(F)COc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 2/20 0.37
▸ MET P08581 2/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ ROCK2 O75116 11/20 0.32
▸ ROCK1 Q13464 9/20 0.32
▸ CDC42BPB Q9Y5S2 3/20 0.32
▸ CDC42BPA Q5VT25 2/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ CHEK1 O14757 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
SCHEMBL26912991 0.86 CGAS (0.38) CGASMETROCK2ROCK1CDC42BPB
SCHEMBL26912403 0.85 CGAS (0.36) CGASMETNTRK1ROCK2ROCK1
SCHEMBL26912988 0.84 CGAS (0.37) CGASMETROCK2ROCK1CDC42BPB
SCHEMBL26913392 0.84 CGAS (0.37) CGASMETROCK2ROCK1CDC42BPB
SCHEMBL26912975 0.83 CGAS (0.40) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26913181 0.81 CGAS (0.39) CGASMETROCK2ROCK1CDC42BPB
SCHEMBL26912534 0.81 CGAS (0.39) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912645 0.80 PDK2 (0.41) CGASROCK2ROCK1
SCHEMBL26913426 0.76 — —
SCHEMBL26913053 0.76 CGAS (0.38) CGASMETROCK2ROCK1CDC42BPB

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 1/4885MET 3936/4885NTRK1 4636/4885

“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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