SCHEMBL8240995

SCHEMBL8240995

[C-]#[N+]c1cn2ccnc2c(SC)n1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
NUDT1 P36639 1/20 0.31

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
SCHEMBL13155401 0.77 L3MBTL1 (0.42) L3MBTL1NUDT1
SCHEMBL13693180 0.76 L3MBTL1 (0.38) L3MBTL1NUDT1
SCHEMBL104697 0.72 L3MBTL1 (0.35) L3MBTL1NUDT1
SCHEMBL103804 0.72 NUDT1 (0.46) L3MBTL1NUDT1
SCHEMBL8241472 0.70 TTK (0.33)
SCHEMBL19616357 0.70 L3MBTL1 (0.33) L3MBTL1NUDT1
SCHEMBL9938832 0.70 KDM4E (0.50)
SCHEMBL19629179 0.69 L3MBTL1 (0.33) L3MBTL1NUDT1
SCHEMBL14537018 0.68 HRH3 (0.36) L3MBTL1
SCHEMBL14507462 0.68 CXCR4 (0.32) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576085-B2 Imidazopyrazines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2009-08-18 US disclosed
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
US-20060106023-A1 Novel imidazopyrazines as cyclin dependent kinase inhibitors SCHERING CORPORATION 2006-05-18 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 (3 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-20060106023-A1 Novel imidazopyrazines as cyclin dependent kinase inhibitors CDK2, CDKN1A, CDK1 L3MBTL1 3942/4885NUDT1 1845/4885
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors CHEK1, CHEK2, CDKN1A L3MBTL1 2624/4885NUDT1 2800/4885
US-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 L3MBTL1 985/4885NUDT1 3197/4885

“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.