SCHEMBL4941373

SCHEMBL4941373

CN1CCN(C(=O)c2nc3c(-c4cccc(NCCC#N)c4)ccnc3n2COCC[Si](C)(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.35
PRKD1 Q15139 2/20 0.34
BDKRB1 P46663 2/20 0.34
TBK1 Q9UHD2 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
BRAF P15056 3/20 0.32
ATR Q13535 1/20 0.32
MTOR P42345 4/20 0.31
KDM4E B2RXH2 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
NTRK1 P04629 1/20 0.31
TNIK Q9UKE5 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
SCHEMBL4941378 0.90 PRKD1 (0.46) PRKD1TBK1ABL1RIN1ATR
SCHEMBL14027862 0.81 PRKD1 (0.45) PRKD1ABL1ATRKDM4EL3MBTL1
SCHEMBL4936182 0.78 NPC1 (0.38) ABL1MTORKDM4EL3MBTL1
SCHEMBL14027879 0.76 ABL1 (0.38) ABL1MTORKDM4EL3MBTL1
SCHEMBL4936238 0.74 MKNK1 (0.46) ABL1MTORKDM4EL3MBTL1
SCHEMBL4939332 0.73 AVPR1A (0.40) ABL1
SCHEMBL4937180 0.72 NPC1 (0.40) ABL1MTORKDM4EL3MBTL1
SCHEMBL4933006 0.71 PRKD1 (0.39) PRKD1KDM4EJAK2
SCHEMBL4938205 0.71 NPC1 (0.40) BDKRB1ABL1MTOR
SCHEMBL14027870 0.71 TLR7 (0.38) ABL1MTORKDM4EL3MBTL1JAK2

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-20080255085-A1 Novel Imidazo [4,5-b] Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase 3 for Use in the Treatment of Dementia and Neurodegenerative Disorders ASTRAZENECA AB (SE) 2008-10-16 US claimed
US-20080255085-A1 Novel Imidazo [4,5-b] Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase 3 for Use in the Treatment of Dementia and Neurodegenerative Disorders ASTRAZENECA AB (SE) 2008-10-16 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-20080255085-A1 Novel Imidazo [4,5-b] Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase 3 for Use in the Treatment of Dementia and Neurodegenerative Disorders GSK3B, GSK3A, PYGB PDE4D 745/4885PRKD1 400/4885BDKRB1 2176/4885

“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.