SCHEMBL24112098

SCHEMBL24112098

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N(C)CCC1CCN(C(=O)CC(O)C[N+](C)(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 14/20 0.38
▸ PTK6 Q13882 1/20 0.36
▸ ERBB2 P04626 2/20 0.33
▸ MAPKAPK5 Q8IW41 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ MELK Q14680 1/20 0.32

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
Formic Acid SCHEMBL25176081 0.97 TTK (0.36) TTKPTK6ERBB2MAPKAPK5AURKA
SCHEMBL25176080 0.93 TTK (0.36) TTKPTK6ERBB2MAPKAPK5AURKA
SCHEMBL30171524 0.90 TTK (0.42) TTKPTK6MAPKAPK5MELK
SCHEMBL24870852 0.90 TTK (0.42) TTKPTK6MAPKAPK5MELK
SCHEMBL30385187 0.88 TTK (0.40) TTKPTK6
SCHEMBL22122942 0.86 TTK (0.41) TTKPTK6MAPKAPK5AURKA
SCHEMBL22123765 0.86 TTK (0.46) TTKPTK6MAPKAPK5
SCHEMBL25450704 0.86 TTK (0.41) TTKPTK6MAPKAPK5AURKA
Hydrochloric Acid SCHEMBL25167713 0.85 TTK (0.45) TTKPTK6MAPKAPK5
SCHEMBL25450692 0.85 TTK (0.42) TTKPTK6MAPKAPK5AURKA

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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
WO-2021249896-A1 NOVEL IMIDAZOPYRAZINE 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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES IKZF3, RRP15, IK TTK 4336/4885PTK6 925/4885ERBB2 406/4885

“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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