SCHEMBL3385920

SCHEMBL3385920

CC(O)OCC1CCCOC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.30
SLC1A2 P43004 2/20 0.30
SLC1A1 P43005 2/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 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
SCHEMBL3387724 0.89 AOC3 (0.34)
SCHEMBL24914179 0.85 GRM4 (0.30)
SCHEMBL21430660 0.85 GRM4 (0.30)
SCHEMBL24914243 0.82
SCHEMBL11252547 0.78
SCHEMBL10075595 0.78 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1
SCHEMBL3383772 0.77 PIK3CD (0.34) SLC1A3SLC1A2SLC1A1
SCHEMBL10068895 0.77 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1
SCHEMBL21430659 0.75
SCHEMBL12015522 0.75

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-2010018132-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 WO disclosed