Rel-Menthone

Rel-Menthone

SCHEMBL4255703

CC(C)C1C=CC(=O)CC1.CC(C)[C@H]1CC[C@H](C)CC1=O

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 3/20 0.36
NPC1 O15118 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL3986168 0.81 TLR4 (0.33) TLR4
SCHEMBL21598319 0.81 TLR4 (0.33) TLR4
SCHEMBL440040 0.81 TLR4 (0.33) TLR4
Menthone SCHEMBL21709 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Menthone SCHEMBL901274 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Menthone SCHEMBL13255148 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Rel-Menthone SCHEMBL1868327 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Rel-Menthone SCHEMBL21711 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Menthone SCHEMBL4395963 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1
Menthone SCHEMBL12326763 0.79 TLR4 (0.39) TLR4NPC1L3MBTL1

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-2009117623-A2 PEST CONTROL USING NATURAL PEST CONTROL AGENT BLENDS TYRATECH, INC. (US) 2009-09-24 WO disclosed