SCHEMBL15315928

SCHEMBL15315928

Cc1cn(COCC[Si](C)(C)C)c(/C=N/O)n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.39
DGAT1 O75907 5/20 0.37
KLKB1 P03952 1/20 0.32
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL9958473 0.85 PDE10A (0.35) PDE10ADGAT1
SCHEMBL9958472 0.85 PDE10A (0.35) PDE10ADGAT1
SCHEMBL20752626 0.83
SCHEMBL9958551 0.82 DGAT1 (0.52) PDE10ADGAT1
SCHEMBL9959627 0.82 DGAT1 (0.52) PDE10ADGAT1
SCHEMBL1767786 0.82 PDE10A (0.41) PDE10ADGAT1KLKB1
SCHEMBL20531562 0.80 DGAT1 (0.38) PDE10ADGAT1KLKB1KDM4E
SCHEMBL19780157 0.80 DGAT1 (0.38) PDE10ADGAT1KLKB1KDM4E
SCHEMBL20531674 0.80 DGAT1 (0.38) PDE10ADGAT1KLKB1KDM4E
SCHEMBL16203617 0.77 ACHE (0.35) DGAT1

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-20130274266-A1 5,6-DIHYDRO-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) JANSSEN PHARMACEUTICA NV (BE) 2013-10-17 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-20130274266-A1 5,6-DIHYDRO-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) BACE2, BACE1, PSEN2 PDE10A 3182/4885DGAT1 2615/4885KLKB1 3570/4885

“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.