SCHEMBL5316262

SCHEMBL5316262

CC(CC1CCOCC1)NN

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.35
PIK3CD O00329 2/20 0.34
CTSK P43235 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
SCHEMBL16002840 0.79 PIK3CD (0.34) CTSDPIK3CD
SCHEMBL3965479 0.79 PDE8B (0.32)
SCHEMBL627733 0.76 PIK3CD (0.38) CTSDPIK3CD
SCHEMBL14975247 0.76 PIK3CD (0.38) CTSDPIK3CD
SCHEMBL16322147 0.76 PIK3CD (0.38) CTSDPIK3CD
SCHEMBL102262 0.75 PIK3CD (0.45) CTSDPIK3CD
Hydrochloric Acid SCHEMBL15992119 0.74 PIK3CD (0.36) CTSDPIK3CD
Hydrochloric Acid SCHEMBL16321736 0.74 PIK3CD (0.36) CTSDPIK3CD
Hydrochloric Acid SCHEMBL3633106 0.74 PIK3CD (0.36) CTSDPIK3CD
SCHEMBL12920128 0.72 CTSD (0.32) CTSD

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-2007117557-A2 DIAMINOPROPANOL RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 WO disclosed