SCHEMBL8258382

SCHEMBL8258382

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cc(CN)ccn1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 17/20 0.42
LOX P28300 8/20 0.42
SYK P43405 1/20 0.41
LOXL3 P58215 1/20 0.38
SSTR4 P31391 1/20 0.36

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
SCHEMBL27047963 0.87 SYK (0.46) SYKSSTR4
SCHEMBL13302742 0.86 SYK (0.43) SYKSSTR4
SCHEMBL8257201 0.86 SYK (0.41) SYKSSTR4
SCHEMBL13302725 0.86 SYK (0.41) SYKSSTR4
SCHEMBL959129 0.86 SYK (0.41) SYKSSTR4
SCHEMBL13302714 0.85 SYK (0.43) SYKSSTR4
SCHEMBL13302743 0.83 SYK (0.39) SYKSSTR4
SCHEMBL21999429 0.81 SYK (0.40) SYKSSTR4
SCHEMBL14510524 0.80 SYK (0.40) SYKSSTR4
SCHEMBL3335527 0.80 NPC1 (0.49) SYKSSTR4

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-2006108039-A2 SUBSTITUTED AZETIDINONES DAIAMED, INC. (US) 2006-10-12 WO disclosed