SCHEMBL13899568

SCHEMBL13899568

Cc1cc(Nc2nc(Sc3ncc[nH]3)cn3c(C4C=NNC4)cnc23)sn1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AURKB Q96GD4 15/20 0.44
▸ AURKA O14965 14/20 0.44
▸ LCK P06239 2/20 0.44
▸ CHEK1 O14757 2/20 0.44
▸ EGFR P00533 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ CSNK1D P48730 1/20 0.44
▸ RPS6KA3 P51812 1/20 0.44
▸ PLK3 Q9H4B4 1/20 0.44
▸ IRAK4 Q9NWZ3 1/20 0.44
▸ PTK6 Q13882 1/20 0.42

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
SCHEMBL13899549 0.88 AURKB (0.46) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899630 0.86 AURKB (0.51) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899514 0.86 AURKB (0.44) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899525 0.82 PTK6 (0.47) AURKBAURKALCKCHEK1EGFR
SCHEMBL14538362 0.82 LCK (0.46) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899629 0.81 PTK6 (0.44) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899609 0.81 AURKA (0.49) AURKBAURKALCKCHEK1EGFR
SCHEMBL14533851 0.80 AURKB (0.47) AURKBAURKALCKCHEK1EGFR
SCHEMBL13155373 0.76 LCK (0.75) AURKBAURKALCKCHEK1EGFR
SCHEMBL13899597 0.69 AURKA (0.43) AURKBAURKALCKCHEK1EGFR

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-7511040-B2 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION (US) 2009-03-31 — — US disclosed
US-20080139571-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2008-06-12 — — 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-20080139571-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS AURKC, AURKA, AURKB AURKB 3/4885AURKA 2/4885LCK 110/4885

“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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