SCHEMBL30187447

SCHEMBL30187447

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)N(C)C5CCNCC5)c(Cl)c4)nccn23)cc1F

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 16/20 0.53
▸ MAPKAPK5 Q8IW41 1/20 0.42
▸ LCK P06239 6/20 0.42
▸ AURKB Q96GD4 5/20 0.42
▸ BCL6 P41182 1/20 0.41
▸ TTK P33981 2/20 0.40

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
SCHEMBL22123761 1.00 PTK6 (0.53) PTK6MAPKAPK5LCKAURKBBCL6
SCHEMBL30187306 0.92 PTK6 (0.45) PTK6MAPKAPK5LCKAURKBTTK
SCHEMBL22142748 0.92 PTK6 (0.45) PTK6MAPKAPK5LCKAURKBTTK
SCHEMBL22122946 0.90 PTK6 (0.51) PTK6MAPKAPK5LCKAURKBBCL6
SCHEMBL30172078 0.90 PTK6 (0.51) PTK6MAPKAPK5LCKAURKBBCL6
SCHEMBL22139165 0.89 PTK6 (0.50) PTK6MAPKAPK5LCKAURKBBCL6
SCHEMBL22139120 0.85 PTK6 (0.54) PTK6MAPKAPK5LCKAURKBBCL6
SCHEMBL30187381 0.85 PTK6 (0.44) PTK6MAPKAPK5LCKAURKBTTK
SCHEMBL22123827 0.85 PTK6 (0.44) PTK6MAPKAPK5LCKAURKBTTK
Hydrochloric Acid SCHEMBL30171709 0.85 PTK6 (0.53) PTK6MAPKAPK5LCKAURKBBCL6

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
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

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 PTK6 1818/4885MAPKAPK5 516/4885LCK 2006/4885

“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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