SCHEMBL25447388

SCHEMBL25447388

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1NC(=O)CN1CCC(N)C1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 15/20 0.40
▸ MAPKAPK5 Q8IW41 2/20 0.37
▸ HTT P42858 1/20 0.36
▸ PTK6 Q13882 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL24104823 0.89 TTK (0.40) TTKMAPKAPK5HTTPTK6
SCHEMBL29106611 0.89 TTK (0.38) TTK
SCHEMBL24104719 0.83 TTK (0.44) TTKMAPKAPK5HTTPTK6
SCHEMBL22124987 0.83 PTK6 (0.48) TTKMAPKAPK5PTK6
SCHEMBL24104804 0.83 EGFR (0.32) HRH3
SCHEMBL22124248 0.81 PTK6 (0.45) TTKMAPKAPK5PTK6
SCHEMBL24105192 0.80 PTK6 (0.47) TTKPTK6
SCHEMBL24104978 0.79 TTK (0.41) TTKMAPKAPK5PTK6
SCHEMBL30177715 0.78 TTK (0.49) TTKMAPKAPK5PTK6
SCHEMBL24870844 0.77 PTK6 (0.47) TTKMAPKAPK5PTK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667264-A Novel imidazo-pyrazine derivatives 豪夫迈·罗氏有限公司 2023-01-31 — — CN claimed
US-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
CN-115667264-A Novel imidazo-pyrazine derivatives 豪夫迈·罗氏有限公司 2023-01-31 — — CN 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-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES XDH, MYD88, IKZF3 TTK 4157/4885MAPKAPK5 771/4885HTT 4251/4885

“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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