SCHEMBL3976032

SCHEMBL3976032

CC(Cc1[c]cccc1)CC(C)c1[c]cccc1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 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
SCHEMBL664142 0.86
SCHEMBL6245462 0.79 TRPA1 (0.34) TRPA1
SCHEMBL2448820 0.78 LARS1 (0.33) TRPA1
SCHEMBL25309170 0.77 TRPA1 (0.32) TRPA1
SCHEMBL1071095 0.77 TRPA1 (0.32) TRPA1
SCHEMBL1145020 0.75 TRPA1 (0.40) TRPA1
SCHEMBL3656632 0.75
SCHEMBL136235 0.74 GABRA1 (0.35)
SCHEMBL3408683 0.74 TSHR (0.31)
SCHEMBL14661575 0.72 RIPK1 (0.31)

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-2054504-A2 RETINOID COMPOUNDS AND THEIR USE REINNERVATE LIMITED (GB) 2009-05-06 EP claimed
WO-2008025965-A2 RETINOID COMPOUNDS AND THEIR USE REINNERVATE LIMITED (GB) 2008-03-06 WO claimed