SCHEMBL24104689

SCHEMBL24104689

COc1ccc(-c2cnc3c(Nc4ccc(CO)c(C)c4)nccn23)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 9/20 0.42
▸ SRC P12931 3/20 0.41
▸ PTK6 Q13882 1/20 0.40
▸ AURKA O14965 3/20 0.39
▸ FLT3 P36888 1/20 0.39
▸ MAPKAPK5 Q8IW41 1/20 0.38
▸ AURKB Q96GD4 2/20 0.38
▸ CLK1 P49759 1/20 0.38
▸ DYRK1A Q13627 1/20 0.38
▸ ZAP70 P43403 1/20 0.37
▸ KARS1 Q15046 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
SCHEMBL30167709 1.00 TTK (0.42) TTKSRCPTK6AURKAFLT3
SCHEMBL30167898 0.89 TTK (0.42) TTKPTK6AURKAMAPKAPK5AURKB
SCHEMBL24105244 0.89 TTK (0.42) TTKPTK6AURKAMAPKAPK5AURKB
SCHEMBL25174076 0.86 CYP11B1 (0.43) TTKSRCAURKAFLT3AURKB
SCHEMBL30168171 0.85 EIF2AK4 (0.46) TTKSRCPTK6AURKAFLT3
SCHEMBL24104677 0.84 SRC (0.44) TTKSRCPTK6AURKAFLT3
Hydrochloric Acid SCHEMBL30168143 0.84 EIF2AK4 (0.45) TTKSRCPTK6AURKAFLT3
SCHEMBL22160298 0.84 TTK (0.48) TTKSRCPTK6AURKAMAPKAPK5
SCHEMBL22123273 0.84 TTK (0.50) TTKSRCPTK6MAPKAPK5
SCHEMBL25173790 0.84 TTK (0.48) TTKSRCPTK6AURKAMAPKAPK5

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
US-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
US-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
WO-2021249893-A1 NOVEL IMIDAZO-PYRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2021-12-16 — — 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-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES XDH, MYD88, IKZF3 TTK 4157/4885SRC 2189/4885PTK6 2213/4885

“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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