SCHEMBL24870837

SCHEMBL24870837

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)N[C@@H](C)CN)c(Cl)c4)nccn23)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 3/20 0.43
▸ TTK P33981 4/20 0.36
▸ IGF1R P08069 1/20 0.36
▸ SYK P43405 3/20 0.35
▸ PDCD1LG2 Q9BQ51 2/20 0.35
▸ CD274 Q9NZQ7 2/20 0.35
▸ BCL6 P41182 2/20 0.35
▸ NCOR2 Q9Y618 1/20 0.35
▸ MAPKAPK5 Q8IW41 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ EGFR P00533 2/20 0.34
▸ FGFR3 P22607 1/20 0.34

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
SCHEMBL24870779 1.00 PTK6 (0.43) PTK6TTKIGF1RSYKPDCD1LG2
SCHEMBL24871020 0.92 TTK (0.41) PTK6TTKSYKMAPKAPK5
SCHEMBL24870834 0.92 TTK (0.41) PTK6TTKSYKMAPKAPK5
SCHEMBL22139126 0.91 TTK (0.36) PTK6TTKSYKMAPKAPK5ALDH1A1
SCHEMBL22139125 0.91 TTK (0.36) PTK6TTKSYKMAPKAPK5ALDH1A1
SCHEMBL24910587 0.91 TTK (0.36) PTK6TTKSYKMAPKAPK5ALDH1A1
Hydrochloric Acid SCHEMBL30172014 0.91 TTK (0.36) PTK6TTKSYKMAPKAPK5ALDH1A1
Hydrochloric Acid SCHEMBL30171967 0.91 TTK (0.36) PTK6TTKSYKMAPKAPK5ALDH1A1
SCHEMBL22123143 0.90 PTK6 (0.41) PTK6TTKIGF1RSYKBCL6
SCHEMBL24870881 0.90 PTK6 (0.41) PTK6TTKIGF1RSYKBCL6

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 1 patent. 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

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 PTK6 2211/4885TTK 4482/4885IGF1R 261/4885

“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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