SCHEMBL14533909

SCHEMBL14533909

CN1CC(c2cnc3c(Nc4cc5ncnc(Cl)c5s4)nccn23)C=N1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 5/20 0.34
▸ AURKB Q96GD4 5/20 0.34
▸ ADORA3 P0DMS8 12/20 0.33

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
SCHEMBL8426673 0.77 AURKA (0.56) AURKAAURKBADORA3
SCHEMBL14533910 0.77 AURKA (0.35) AURKAAURKBADORA3
SCHEMBL12404528 0.76 AURKA (0.60) AURKAAURKB
SCHEMBL8429700 0.73 AURKA (0.63) AURKAAURKBADORA3
SCHEMBL14533966 0.72 AURKA (0.37) AURKAAURKBADORA3
SCHEMBL8427761 0.70 AURKA (0.36) AURKAAURKBADORA3
SCHEMBL12473231 0.70 AURKA (0.34) AURKAAURKBADORA3
SCHEMBL14534093 0.69 AURKA (0.53) AURKAAURKBADORA3
SCHEMBL8426788 0.69 AURKA (0.35) AURKAADORA3
SCHEMBL8429587 0.68 ADORA3 (0.38) AURKAAURKBADORA3

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-20070117804-A1 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION 2007-05-24 — — US disclosed
US-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — 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 (2 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-20070117804-A1 Imidazopyrazines as protein kinase inhibitors CHEK1, CHEK2, CDKN1A AURKA 41/4885AURKB 138/4885ADORA3 3535/4885
US-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 AURKA 5/4885AURKB 24/4885ADORA3 4501/4885

“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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