SCHEMBL7733656

SCHEMBL7733656

CC/C=C/C=C/CO[C@H]1CC[C@H](OC/C=C/C=C/CC)CC1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.35

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
SCHEMBL7733660 1.00 TRPA1 (0.35) TRPA1
SCHEMBL7733662 1.00 TRPA1 (0.35) TRPA1
SCHEMBL8214842 0.94 TRPA1 (0.31) TRPA1
SCHEMBL7734352 0.94 TRPA1 (0.31) TRPA1
SCHEMBL7734354 0.94 TRPA1 (0.31) TRPA1
SCHEMBL8216171 0.84 TLR4 (0.31)
SCHEMBL7734372 0.84 TLR4 (0.31)
SCHEMBL7734375 0.84 TLR4 (0.31)
SCHEMBL7733663 0.82
SCHEMBL7733664 0.82

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-0929508-B1 LIQUID CRYSTALLINE (E,E)-BUTADIENE COMPOUNDS AND MIXTURES AND DEVICES CONTAINING SUCH COMPOUNDS QINETIQ LTD (GB) 2002-03-20 EP disclosed
US-6106908-A OPTICAL APPARATUS WITH LIQUID CRYSTAL COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2000-08-22 US disclosed