SCHEMBL24870930

SCHEMBL24870930

CCc1cc(Nc2nccn3c(-c4ccc(OC(F)F)c(F)c4F)cnc23)ccc1C(=O)NCC1CCNC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 3/20 0.38
▸ PTK6 Q13882 1/20 0.38
▸ TTK P33981 5/20 0.36
▸ JAK2 O60674 6/20 0.33
▸ JAK1 P23458 6/20 0.33
▸ MAPKAPK5 Q8IW41 1/20 0.33
▸ EIF4E P06730 2/20 0.32
▸ MKNK1 Q9BUB5 2/20 0.32
▸ MKNK2 Q9HBH9 2/20 0.32
▸ NAMPT P43490 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
SCHEMBL30172036 1.00 PTK2 (0.38) PTK2PTK6TTKJAK2JAK1
SCHEMBL22122856 0.93 PTK2 (0.43) PTK2PTK6TTKJAK2JAK1
SCHEMBL22123294 0.93 PTK2 (0.43) PTK2PTK6TTKJAK2JAK1
Hydrochloric Acid SCHEMBL30172045 0.92 PTK2 (0.43) PTK2PTK6TTKJAK2JAK1
Hydrochloric Acid SCHEMBL30171580 0.92 PTK2 (0.43) PTK2PTK6TTKJAK2JAK1
SCHEMBL30384707 0.92 PTK6 (0.39) PTK2PTK6TTKJAK2JAK1
SCHEMBL24870950 0.91 PTK6 (0.36) PTK2PTK6TTKJAK2JAK1
SCHEMBL22125159 0.91 PTK6 (0.41) PTK2PTK6TTKJAK2JAK1
SCHEMBL30385656 0.91 PTK6 (0.41) PTK2PTK6TTKJAK2JAK1
SCHEMBL30385760 0.90 PTK6 (0.37) PTK2PTK6TTKJAK2JAK1

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
CN-113195497-A Novel imidazopyrazine derivatives 豪夫迈·罗氏有限公司 2021-07-30 — — CN claimed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US disclosed
CN-113195497-A Novel imidazopyrazine derivatives 豪夫迈·罗氏有限公司 2021-07-30 — — CN 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 PTK2 4090/4885PTK6 2211/4885TTK 4482/4885

“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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