SCHEMBL4351365

SCHEMBL4351365

CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CNC(=O)CC(=O)NCc1ccc(C)c(-c2cccc(CN3CCN(CC)CC3)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 12/20 0.45
MAPK14 Q16539 1/20 0.36
CHRM3 P20309 2/20 0.36
ENPP2 Q13822 3/20 0.36
MAPK1 P28482 1/20 0.35
PIK3CD O00329 1/20 0.35

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
SCHEMBL4349715 0.98 PDE4B (0.45) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4352123 0.96 PDE4B (0.44) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4358207 0.96 PDE4B (0.44) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4352243 0.96 PDE4B (0.45) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4361533 0.95 PDE4B (0.44) PDE4BCHRM3
SCHEMBL4355042 0.94 PDE4B (0.43) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4364378 0.94 PDE4B (0.44) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4355997 0.93 PDE4B (0.44) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4099311 0.93 PDE4B (0.47) PDE4BMAPK14CHRM3ENPP2MAPK1
SCHEMBL4351891 0.93 PDE4B (0.45) PDE4BCHRM3

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-8071588-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-12-06 US claimed
US-20090203677-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics GLAXO GROUP LIMITED (GB) 2009-08-13 US claimed
US-8071588-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-12-06 US disclosed
US-20090203677-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics GLAXO GROUP LIMITED (GB) 2009-08-13 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-20090203677-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics PDE4A, PDE4B, PDE1A PDE4B 2/4885MAPK14 1300/4885CHRM3 20/4885

“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.