SCHEMBL22123384

SCHEMBL22123384

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N(C)CC(=O)N1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK5 Q8IW41 9/20 0.44
▸ PTK6 Q13882 2/20 0.40
▸ AURKB Q96GD4 2/20 0.40
▸ LCK P06239 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ TTK P33981 6/20 0.39
▸ AURKA O14965 1/20 0.39
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL22122880 0.93 PTK6 (0.41) MAPKAPK5PTK6LCKTTKAURKA
SCHEMBL22123560 0.90 PTK6 (0.39) MAPKAPK5PTK6AURKBLCKTTK
SCHEMBL22123812 0.89 MAPKAPK5 (0.44) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL22123081 0.88 MAPKAPK5 (0.45) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL30171591 0.88 MAPKAPK5 (0.43) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL22160299 0.88 MAPKAPK5 (0.43) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL22124099 0.86 PTK6 (0.47) MAPKAPK5PTK6AURKBLCKTTK
SCHEMBL22139099 0.86 MAPKAPK5 (0.50) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL30171560 0.86 MAPKAPK5 (0.50) MAPKAPK5PTK6AURKBLCKFYN
SCHEMBL22139078 0.85 TTK (0.42) MAPKAPK5PTK6TTKAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US disclosed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US disclosed
EP-3898631-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — 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-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 MAPKAPK5 647/4885PTK6 2211/4885AURKB 3359/4885

“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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