SCHEMBL725337

SCHEMBL725337

CC1CCC(C(C)(C)O)[C@H](O)C1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.43
TRPM8 Q7Z2W7 2/20 0.43
GBA1 P04062 1/20 0.38
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL14548162 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL80731 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL14130407 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL80732 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL13559128 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL12449334 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL18271744 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL14130644 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL12521907 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2
SCHEMBL13619173 1.00 TRPA1 (0.43) TRPA1TRPM8GBA1CA1CA2

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-2011161426-A1 COMPOSITION COMPRISING PARA -MENTHANE - 3, 8 - DIOL FOR CONTROLLING MITES DELL IAN THOMAS (GB) 2011-12-29 WO disclosed