SCHEMBL29919730

SCHEMBL29919730

COc1cc2[nH]ncc2cc1Nc1ncnc(N)c1OC

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 16/20 0.72
▸ LCK P06239 2/20 0.49
▸ ROCK2 O75116 2/20 0.48
▸ MKNK2 Q9HBH9 1/20 0.47

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
SCHEMBL28936235 1.00 MKNK1 (0.72) MKNK1LCKROCK2MKNK2
SCHEMBL29919772 0.88 MKNK1 (0.72) MKNK1ROCK2MKNK2
SCHEMBL28936225 0.88 MKNK1 (0.72) MKNK1ROCK2MKNK2
SCHEMBL29919691 0.87 MKNK1 (0.71) MKNK1ROCK2
SCHEMBL28936540 0.87 MKNK1 (0.71) MKNK1ROCK2
SCHEMBL28936156 0.87 MKNK1 (0.71) MKNK1ROCK2
SCHEMBL29919744 0.87 MKNK1 (0.71) MKNK1ROCK2
SCHEMBL29919757 0.85 MKNK1 (0.68) MKNK1ROCK2
SCHEMBL28936251 0.85 MKNK1 (0.68) MKNK1ROCK2
SCHEMBL17394775 0.84 MKNK1 (1.00) MKNK1LCKROCK2

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-20220289719-A1 HETEROCYCLIC COMPOUNDS AS MNK INHIBITORS NANJING INNOCARE PHARMA TECH CO., LTD. (CN) 2022-09-15 — — 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-20220289719-A1 HETEROCYCLIC COMPOUNDS AS MNK INHIBITORS NIM1K, MAP3K1, MAPKAPK2 MKNK1 28/4885LCK 229/4885ROCK2 701/4885

“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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