SCHEMBL30168204

SCHEMBL30168204

COc1ccc(-c2cnc3c(Nc4ccc(NC(=O)CO)cc4)nccn23)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 1/20 0.46
▸ TTK P33981 5/20 0.45
▸ ALDH1A1 P00352 3/20 0.42
▸ MAPT P10636 3/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ IGF1R P08069 1/20 0.40
▸ AURKA O14965 2/20 0.40
▸ MAPKAPK5 Q8IW41 2/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAPK3 P27361 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KDR P35968 1/20 0.39

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
SCHEMBL25167794 1.00 PTK6 (0.46) PTK6TTKALDH1A1MAPTRXFP1
SCHEMBL24105218 0.90 PTK6 (0.47) PTK6TTKALDH1A1AURKAMAPKAPK5
SCHEMBL24105193 0.90 MAPKAPK5 (0.47) PTK6TTKIGF1RAURKAMAPKAPK5
SCHEMBL30168133 0.88 PTK6 (0.42) PTK6TTKALDH1A1MAPTRXFP1
SCHEMBL25170919 0.88 PTK6 (0.42) PTK6TTKALDH1A1MAPTRXFP1
SCHEMBL30167861 0.86 PTK6 (0.41) PTK6TTKALDH1A1MAPTRXFP1
SCHEMBL24105205 0.86 KDR (0.48) PTK6ALDH1A1MAPTAURKAMAPKAPK5
SCHEMBL24104736 0.86 PTK6 (0.41) PTK6TTKALDH1A1MAPTRXFP1
SCHEMBL22139065 0.86 MAPKAPK5 (0.54) PTK6TTKMAPKAPK5KDR
SCHEMBL24105217 0.85 PTK6 (0.45) PTK6TTKMAPTAURKAMAPKAPK5

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
US-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
CN-115667264-A Novel imidazo-pyrazine derivatives 豪夫迈·罗氏有限公司 2023-01-31 — — 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-20230141403-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES XDH, MYD88, IKZF3 PTK6 2213/4885TTK 4157/4885ALDH1A1 2986/4885

“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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