SCHEMBL5780930

SCHEMBL5780930

CC(C)COC(=O)NC(=N)C1C=CC2=CN(CC(=O)c3ccc(OCC(=O)OC(C)C)cc3)CC2C1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
HRH3 Q9Y5N1 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
SCHEMBL5783526 0.95 HRH3 (0.32) MAPTHRH3
SCHEMBL5785818 0.89 NPC1 (0.37) MAPT
SCHEMBL5783613 0.89 MAPT (0.35) MAPT
SCHEMBL5784021 0.87 HRH3 (0.32) MAPTHRH3
SCHEMBL5784888 0.84 HRH3 (0.33) MAPTHRH3
SCHEMBL5787589 0.84 MAPT (0.35) MAPT
SCHEMBL5782142 0.82 MAPT (0.36) MAPT
SCHEMBL5786633 0.82 L3MBTL1 (0.34) MAPT
SCHEMBL5787633 0.80 MAPT (0.33) MAPT
SCHEMBL5786495 0.80 MAPT (0.38) MAPTHRH3

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
EP-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP claimed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 WO claimed
EP-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP disclosed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 WO disclosed