SCHEMBL22123038

SCHEMBL22123038

CCc1cc(Nc2nccn3c(-c4ccc(OC)c(F)c4F)cnc23)ccc1C(=O)NCC1COC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 9/20 0.38
▸ MAPKAPK5 Q8IW41 1/20 0.37
▸ PTK6 Q13882 1/20 0.36
▸ PTK2 Q05397 3/20 0.36
▸ AXL P30530 2/20 0.34
▸ ALDH2 P05091 1/20 0.34
▸ CNR2 P34972 2/20 0.33
▸ SYK P43405 1/20 0.33

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
SCHEMBL30171920 1.00 TTK (0.38) TTKMAPKAPK5PTK6PTK2AXL
SCHEMBL24870895 0.92 PTK6 (0.36) TTKMAPKAPK5PTK6PTK2AXL
SCHEMBL30171671 0.92 PTK6 (0.36) TTKMAPKAPK5PTK6PTK2AXL
SCHEMBL22123264 0.90 PTK2 (0.46) TTKMAPKAPK5PTK6PTK2CNR2
SCHEMBL22122856 0.89 PTK2 (0.43) TTKMAPKAPK5PTK6PTK2
SCHEMBL30172079 0.89 PTK6 (0.36) TTKMAPKAPK5PTK6PTK2AXL
SCHEMBL22123023 0.89 PTK6 (0.36) TTKMAPKAPK5PTK6PTK2AXL
SCHEMBL22123294 0.89 PTK2 (0.43) TTKMAPKAPK5PTK6PTK2
Hydrochloric Acid SCHEMBL30171580 0.89 PTK2 (0.43) TTKMAPKAPK5PTK6PTK2
Hydrochloric Acid SCHEMBL30172045 0.89 PTK2 (0.43) TTKMAPKAPK5PTK6PTK2

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
EP-3898631-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP claimed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO claimed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US 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 TTK 4482/4885MAPKAPK5 647/4885PTK6 2211/4885

“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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