SCHEMBL30171874

SCHEMBL30171874

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)N(C)CCCC(=O)N5CCOC(CN)C5)c(C)c4)nccn23)cc1F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK5 Q8IW41 2/20 0.42
▸ EPHA2 P29317 9/20 0.39
▸ KDR P35968 9/20 0.39
▸ EPHB4 P54760 7/20 0.39
▸ PTK6 Q13882 3/20 0.38
▸ TTK P33981 3/20 0.37
▸ AURKB Q96GD4 2/20 0.36
▸ SYK P43405 2/20 0.35
▸ FYN P06241 1/20 0.34

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
SCHEMBL22122869 1.00 MAPKAPK5 (0.42) MAPKAPK5EPHA2KDREPHB4PTK6
SCHEMBL22123525 0.89 PTK6 (0.48) MAPKAPK5PTK6TTKAURKB
SCHEMBL22124850 0.88 MAPKAPK5 (0.41) MAPKAPK5EPHA2KDREPHB4PTK6
SCHEMBL22123388 0.88 PTK6 (0.47) MAPKAPK5PTK6TTKAURKBSYK
SCHEMBL22123086 0.85 PTK6 (0.48) MAPKAPK5PTK6TTKAURKB
SCHEMBL22122913 0.85 MAPKAPK5 (0.41) MAPKAPK5PTK6TTKAURKBSYK
SCHEMBL30171674 0.85 MAPKAPK5 (0.41) MAPKAPK5PTK6TTKAURKBSYK
SCHEMBL22124719 0.85 TTK (0.41) MAPKAPK5EPHA2KDREPHB4PTK6
SCHEMBL22124191 0.85 MAPKAPK5 (0.43) MAPKAPK5EPHA2KDREPHB4PTK6
SCHEMBL22123261 0.85 MAPKAPK5 (0.42) MAPKAPK5EPHA2KDREPHB4PTK6

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
EP-3898631-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — 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-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 MAPKAPK5 647/4885EPHA2 4729/4885KDR 4212/4885

“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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