Isopulegol

Isopulegol

SCHEMBL1868660

C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1O.CC(C)=C1CC[C@@H](C)C[C@H]1O

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.33
TRPM8 Q7Z2W7 2/20 0.33

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
SCHEMBL291585 0.83 TLR4 (0.34) TRPA1TRPM8
SCHEMBL2684088 0.83 TLR4 (0.34) TRPA1TRPM8
SCHEMBL24024236 0.83 TLR4 (0.34) TRPA1TRPM8
Isopulegol SCHEMBL8815146 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL8815381 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL8632368 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL20903638 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL20903648 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL20681722 0.81 TRPA1 (0.45) TRPA1TRPM8
Isopulegol SCHEMBL12044788 0.81 TRPA1 (0.45) TRPA1TRPM8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496682-A1 DELIVERY PARTICLE The Procter & Gamble Company (US) 2012-09-12 EP disclosed
WO-2011056935-A1 DELIVERY PARTICLE THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed