SCHEMBL24112644

SCHEMBL24112644

CCc1cc(Nc2nccn3c(-c4ccc(OC(F)F)c(F)c4F)cnc23)ccc1C(=O)N1CCN(C(=O)C2CC[N+](C)(CC3CNC3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 17/20 0.39
▸ AURKB Q96GD4 7/20 0.33
▸ LCK P06239 7/20 0.33
▸ TBK1 Q9UHD2 2/20 0.31
▸ TTK P33981 1/20 0.30

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
SCHEMBL32675710 1.00 PTK6 (0.39) PTK6AURKBLCKTBK1TTK
Trifluoroacetic Acid SCHEMBL30385230 0.96 PTK6 (0.36) PTK6AURKBLCKTBK1TTK
SCHEMBL32675702 0.96 PTK6 (0.39) PTK6AURKBLCKTBK1TTK
SCHEMBL24112409 0.96 PTK6 (0.39) PTK6AURKBLCKTBK1TTK
SCHEMBL24112641 0.96 PTK6 (0.39) PTK6AURKBLCK
Trifluoroacetic Acid SCHEMBL25176066 0.93 PTK6 (0.37) PTK6AURKBLCKTTK
SCHEMBL24112613 0.92 PTK6 (0.39) PTK6AURKBLCKTTK
SCHEMBL24112475 0.92 PTK6 (0.35) PTK6
SCHEMBL32675699 0.92 PTK6 (0.34) PTK6
SCHEMBL24112470 0.92 PTK6 (0.34) PTK6

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 PTK6 925/4885AURKB 4161/4885LCK 1817/4885

“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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