SCHEMBL4455585

SCHEMBL4455585

NC(=O)c1nc(N)[c]c(=O)[nH]1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 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
SCHEMBL3230029 0.65 CYP3A4 (0.57) —
SCHEMBL10842137 0.65 GSK3B (0.34) —
SCHEMBL15769086 0.64 LMNA (0.65) —
SCHEMBL8670138 0.60 KDM4E (0.32) PDPK1
SCHEMBL14091342 0.60 PDPK1 (0.36) PDPK1
SCHEMBL11184996 0.60 SCN9A (0.38) —
SCHEMBL8561 0.60 — —
SCHEMBL7259185 0.60 — —
SCHEMBL3216284 0.59 GAA (0.50) —
SCHEMBL2466217 0.58 PDPK1 (0.32) PDPK1

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
WO-2009138122-A1 PURINE DERIVATIVES FURTHER COMPRISING A MERCAPTO-ACYLAMINO GROUP AS NEUTRAL ENDOPEPTIDASE INHIBITORS NOVARTIS AG (CH) 2009-11-19 — — WO disclosed
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