SCHEMBL24916602

SCHEMBL24916602

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N(C)CCOCC(=O)N1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 15/20 0.46
▸ AURKB Q96GD4 7/20 0.39
▸ TTK P33981 3/20 0.39
▸ LCK P06239 6/20 0.38
▸ SYK P43405 1/20 0.36
▸ MAPKAPK5 Q8IW41 1/20 0.36

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
SCHEMBL22124838 0.91 PTK6 (0.44) PTK6AURKBTTKLCKSYK
SCHEMBL22123719 0.89 PTK6 (0.46) PTK6AURKBTTKLCKMAPKAPK5
SCHEMBL22123813 0.88 PTK6 (0.46) PTK6AURKBTTKLCKMAPKAPK5
SCHEMBL22125090 0.86 TTK (0.39) PTK6TTKMAPKAPK5
SCHEMBL22123765 0.85 TTK (0.46) PTK6AURKBTTKLCKMAPKAPK5
Hydrochloric Acid SCHEMBL25167713 0.85 TTK (0.45) PTK6AURKBTTKLCKMAPKAPK5
SCHEMBL22123379 0.85 PTK6 (0.61) PTK6AURKBTTKLCK
SCHEMBL30183757 0.85 PTK6 (0.61) PTK6AURKBTTKLCK
SCHEMBL22139078 0.85 TTK (0.42) PTK6TTKMAPKAPK5
SCHEMBL30171633 0.85 TTK (0.42) PTK6TTKMAPKAPK5

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-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 — — 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-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2141/4885AURKB 3352/4885TTK 4573/4885

“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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