SCHEMBL22124854

SCHEMBL22124854

COc1ccc(-c2cnc3c(Nc4cc(C)c(C(=O)NCCOCCOCCN)c(F)c4)nccn23)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.35
▸ ZAP70 P43403 7/20 0.35
▸ KARS1 Q15046 6/20 0.35
▸ SYK P43405 5/20 0.35
▸ TTK P33981 5/20 0.33
▸ MAPKAPK5 Q8IW41 1/20 0.32
▸ FLT1 P17948 1/20 0.32
▸ FLT4 P35916 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ IDO1 P14902 2/20 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
SCHEMBL22124722 0.99 PDE10A (0.35) PDE10AZAP70KARS1SYKTTK
Formic Acid SCHEMBL22123789 0.97 PDE10A (0.34) PDE10AZAP70KARS1SYKTTK
SCHEMBL22125062 0.95 ZAP70 (0.37) PDE10AZAP70KARS1SYKTTK
SCHEMBL22123589 0.94 TTK (0.35) PDE10AZAP70KARS1SYKTTK
SCHEMBL30171789 0.94 PDE10A (0.35) PDE10AZAP70KARS1SYKTTK
SCHEMBL22124566 0.94 PDE10A (0.35) PDE10AZAP70KARS1SYKTTK
SCHEMBL24112394 0.94 TTK (0.34) ZAP70KARS1SYKTTKPTK2
SCHEMBL24916615 0.93 PDE10A (0.36) PDE10AZAP70KARS1SYKTTK
SCHEMBL22123380 0.93 ZAP70 (0.39) ZAP70KARS1SYKTTKPTK2
SCHEMBL30171548 0.93 ZAP70 (0.39) ZAP70KARS1SYKTTKPTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898630-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-05-10 — — EP claimed
EP-3898630-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP claimed
WO-2020126954-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO claimed
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 — — US disclosed
EP-3898630-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
WO-2020126954-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES 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-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PDE10A 2096/4885ZAP70 716/4885KARS1 610/4885

“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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