SCHEMBL28936080

SCHEMBL28936080

COc1cc2[nH]ncc2cc1Nc1cc(Nc2cnccn2)ncn1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 15/20 0.57
▸ ROCK2 O75116 2/20 0.45
▸ AXL P30530 1/20 0.44
▸ TLR8 Q9NR97 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.41

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
SCHEMBL29919796 1.00 MKNK1 (0.57) MKNK1ROCK2AXLTLR8IRAK4
SCHEMBL28936099 0.85 MKNK1 (0.56) MKNK1ROCK2AXLIRAK4
SCHEMBL29919854 0.85 MKNK1 (0.56) MKNK1ROCK2AXLIRAK4
SCHEMBL28936211 0.84 MKNK1 (0.62) MKNK1ROCK2AXL
SCHEMBL29919723 0.84 MKNK1 (0.62) MKNK1ROCK2AXL
SCHEMBL28936107 0.84 MKNK1 (0.57) MKNK1ROCK2AXL
SCHEMBL28936250 0.84 MKNK1 (0.59) MKNK1ROCK2AXLIRAK4
SCHEMBL29919828 0.84 MKNK1 (0.59) MKNK1ROCK2AXLIRAK4
SCHEMBL28936150 0.82 MKNK1 (0.62) MKNK1ROCK2AXL
SCHEMBL28936119 0.82 MKNK1 (0.66) MKNK1ROCK2AXL

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
CN-109020957-B Heterocyclic compounds as MNK inhibitors 南京天印健华医药科技有限公司(CN) 2023-01-13 — — CN disclosed
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 28/4885ROCK2 701/4885AXL 1440/4885

“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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