SCHEMBL935452

SCHEMBL935452

CCCCC/C=C\C/C=C\CCCCCCCCOCCCOC(C)(CN(C)C)OCCCCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL12462210 0.94 ALDH1A1 (0.45) ALDH1A1CNR1CNR2
SCHEMBL14715889 0.94 ALDH1A1 (0.45) ALDH1A1CNR1CNR2
SCHEMBL2301357 0.90 LPAR2 (0.44)
SCHEMBL18546023 0.82 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL18546028 0.82 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL15054267 0.82 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL2519902 0.82 DNM1 (0.39)
SCHEMBL6263292 0.82 DNM1 (0.39)
SCHEMBL18545973 0.82 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL16510791 0.82 ALDH1A1 (0.56) ALDH1A1CNR1CNR2

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-2011011447-A1 COMPOSITIONS AND METHODS FOR SILENCING EBOLA VIRUS GENE EXPRESSION PROTIVA BIOTHERAPEUTICS, INC. (CA) 2011-01-27 WO disclosed