SCHEMBL26912807

SCHEMBL26912807

O=C(Nc1cc(Cl)c(Cl)c2[nH]nc(-c3cn[nH]c3)c12)C(F)F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.38
▸ NTRK1 P04629 10/20 0.36
▸ ROCK1 Q13464 2/20 0.34
▸ MYLK4 Q86YV6 1/20 0.34
▸ ROCK2 O75116 6/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ CGAS Q8N884 1/20 0.33

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
SCHEMBL30684441 1.00 MAPK1 (0.38) MAPK1NTRK1ROCK1MYLK4ROCK2
SCHEMBL26913442 0.84 CGAS (0.39) MAPK1NTRK1ROCK1ROCK2IRAK4
SCHEMBL30684349 0.84 CGAS (0.39) MAPK1NTRK1ROCK1ROCK2IRAK4
SCHEMBL26913242 0.82 CGAS (0.38) ROCK1MYLK4ROCK2IRAK4CGAS
SCHEMBL26912712 0.78 CGAS (0.39) ROCK1MYLK4ROCK2IRAK4CGAS
SCHEMBL26912544 0.76 CGAS (0.38) ROCK1MYLK4ROCK2IRAK4CGAS
SCHEMBL26913157 0.75 CGAS (0.35) ROCK1MYLK4ROCK2CGAS
SCHEMBL26912713 0.75 CGAS (0.34) NTRK1CGAS
SCHEMBL30684371 0.73 PIM1 (0.34) MAPK1NTRK1CGAS
SCHEMBL26913265 0.73 PIM1 (0.34) MAPK1NTRK1CGAS

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPK1 1900/4885NTRK1 4636/4885ROCK1 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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