SCHEMBL30172107

SCHEMBL30172107

COc1ccc(-c2cnc3c(Nc4ccc(C(N)=O)c(Cl)c4)nccn23)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 3/20 0.48
▸ SYK P43405 11/20 0.44
▸ MAPKAPK5 Q8IW41 1/20 0.43
▸ CSF1R P07333 5/20 0.42
▸ MAP4K4 O95819 2/20 0.38
▸ MAP4K2 Q12851 2/20 0.38
▸ PKN2 Q16513 2/20 0.38
▸ AURKB Q96GD4 2/20 0.38
▸ SLK Q9H2G2 2/20 0.38
▸ AURKA O14965 1/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ INSR P06213 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ LYN P07948 1/20 0.38
▸ RET P07949 1/20 0.38
▸ ROS1 P08922 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ FER P16591 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ BLK P51451 1/20 0.38

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
SCHEMBL22139113 1.00 PTK6 (0.48) PTK6SYKMAPKAPK5CSF1RMAP4K4
SCHEMBL22123969 0.92 PTK6 (0.48) PTK6SYKMAPKAPK5AURKBAURKA
SCHEMBL30385303 0.92 PTK6 (0.48) PTK6SYKMAPKAPK5AURKBAURKA
SCHEMBL30385212 0.92 PTK6 (0.50) PTK6SYKMAPKAPK5AURKBLCK
SCHEMBL30171749 0.91 SYK (0.49) PTK6SYKMAPKAPK5CSF1RMAP4K4
SCHEMBL22125440 0.90 PTK6 (0.59) PTK6AURKBLCK
SCHEMBL30171569 0.90 PTK6 (0.59) PTK6AURKBLCK
SCHEMBL24940106 0.89 SYK (0.44) PTK6SYKMAPKAPK5CSF1RMAP4K4
Hydrochloric Acid SCHEMBL30349837 0.89 SYK (0.43) PTK6SYKMAPKAPK5CSF1RMAP4K4
Trifluoroacetic Acid SCHEMBL30386106 0.88 PTK6 (0.47) PTK6SYKMAPKAPK5AURKBLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898631-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
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 2211/4885SYK 954/4885MAPKAPK5 647/4885

“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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