SCHEMBL26912510

SCHEMBL26912510

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

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 2/20 0.35
▸ ROCK2 O75116 13/20 0.34
▸ ROCK1 Q13464 13/20 0.34
▸ CDC42BPB Q9Y5S2 3/20 0.34
▸ CDC42BPA Q5VT25 2/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ MAPK8 P45983 1/20 0.32
▸ MAPK9 P45984 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ CHUK O15111 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ PIM2 Q9P1W9 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
SCHEMBL26912433 0.88 ROCK2 (0.40) CGASROCK2ROCK1CDC42BPBIRAK4
SCHEMBL26913748 0.82 USP2 (0.43) CGASROCK2ROCK1
SCHEMBL26913323 0.82 CGAS (0.44) CGASROCK2ROCK1IRAK4
Hydrochloric Acid SCHEMBL26913201 0.81 CGAS (0.36) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912804 0.81 PGK1 (0.40) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912243 0.81 CGAS (0.39) CGASROCK2ROCK1IRAK4
SCHEMBL26913242 0.81 CGAS (0.38) CGASROCK2ROCK1IRAK4
SCHEMBL26912854 0.79 CGAS (0.39) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26912685 0.78 CGAS (0.35) CGASROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30684281 0.76 CHUK (0.38) CGASROCK2ROCK1CDC42BPBCDC42BPA

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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