SCHEMBL22139064

SCHEMBL22139064

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)N(C)CC=O)c(C)c4)nccn23)cc1F

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK5 Q8IW41 1/20 0.46
▸ TTK P33981 9/20 0.43
▸ SYK P43405 5/20 0.42
▸ PTK6 Q13882 3/20 0.42
▸ AURKB Q96GD4 2/20 0.39
▸ AURKA O14965 1/20 0.38
▸ CDK2 P24941 1/20 0.37

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
SCHEMBL22142784 0.92 MAPKAPK5 (0.41) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22123361 0.91 MAPKAPK5 (0.44) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22139098 0.90 MAPKAPK5 (0.43) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL30171903 0.90 MAPKAPK5 (0.43) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22123692 0.90 MAPKAPK5 (0.43) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22154245 0.89 MAPKAPK5 (0.42) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL25012869 0.89 TTK (0.39) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22124079 0.88 MAPKAPK5 (0.42) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL22123157 0.88 TTK (0.44) MAPKAPK5TTKSYKPTK6AURKB
SCHEMBL30171704 0.88 TTK (0.44) MAPKAPK5TTKSYKPTK6AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898630-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-05-10 — — EP disclosed
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 — — US disclosed
EP-3898629-B1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
EP-3898631-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
WO-2020126952-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126954-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126956-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020127075-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO 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-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES IL4, RPS4Y1, RPS4X MAPKAPK5 516/4885TTK 4519/4885SYK 868/4885

“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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