SCHEMBL7756399

SCHEMBL7756399

CCCCC(N)C1(CC)CO1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
DNM1 Q05193 1/20 0.30

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
SCHEMBL28278614 0.69 OPRM1 (0.41) OPRM1SLC6A4SLC6A3
SCHEMBL9242887 0.69 GPR84 (0.35)
SCHEMBL4533483 0.68 GPR84 (0.38)
SCHEMBL12352257 0.65 OPRM1 (0.41) OPRM1SLC6A4SLC6A3
SCHEMBL10914883 0.65 OPRM1 (0.41) OPRM1SLC6A4SLC6A3
SCHEMBL3422639 0.64
SCHEMBL8990179 0.64 ALDH1A1 (0.38) OPRM1SLC6A4SLC6A3ALDH1A1
SCHEMBL11287401 0.61 DNM1 (0.32) OPRM1SLC6A4SLC6A3DNM1
SCHEMBL24017046 0.60 OPRM1 (0.50) OPRM1ALDH1A1TDP1DNM1
SCHEMBL308712 0.60

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-1072673-A2 Perfume compositions THE PROCTER & GAMBLE COMPANY (US) 2001-01-31 EP disclosed
WO-2001005919-A2 PERFUME COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-01-25 WO disclosed