SCHEMBL4936841

SCHEMBL4936841

CN1CCN(C(=O)c2ccc(-c3nc4c(-c5cccc(O)c5)ccnc4n3OCOCC[Si](C)(C)C)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 5/20 0.44
MKNK2 Q9HBH9 5/20 0.44
AVPR2 P30518 2/20 0.38
AVPR1A P37288 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MTOR P42345 3/20 0.37
PIK3CA P42336 2/20 0.37
POLB P06746 1/20 0.37
RIPK1 Q13546 1/20 0.37
ACVR1 Q04771 1/20 0.36
NPC1 O15118 1/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
KDR P35968 1/20 0.35
SLC6A7 Q99884 1/20 0.35
BDKRB1 P46663 1/20 0.34

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
SCHEMBL4937452 0.89 NPC1 (0.39) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL4936238 0.89 MKNK1 (0.46) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL4939677 0.87 NPC1 (0.37) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL14027879 0.79 ABL1 (0.38) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL14027866 0.79 AVPR2 (0.44) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL4937180 0.78 NPC1 (0.40) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL14027870 0.78 TLR7 (0.38) MKNK1MKNK2AVPR2AVPR1AL3MBTL1
SCHEMBL4938205 0.78 NPC1 (0.40) MKNK1MKNK2AVPR2AVPR1AMTOR
SCHEMBL4936885 0.77 NPC1 (0.41) AVPR2AVPR1ARIPK1NPC1ABL1
SCHEMBL4939332 0.77 AVPR1A (0.40) AVPR2AVPR1APOLBRIPK1NPC1

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 MKNK1 345/4885MKNK2 348/4885AVPR2 3952/4885

“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.