SCHEMBL9313328

SCHEMBL9313328

CCC/C=C/C1CCC(C(C#N)C(=O)OCC)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL9313332 1.00 L3MBTL1 (0.31) L3MBTL1
SCHEMBL9313339 1.00 L3MBTL1 (0.31) L3MBTL1
SCHEMBL9313319 1.00 L3MBTL1 (0.31) L3MBTL1
SCHEMBL546205 0.83 L3MBTL1 (0.41) L3MBTL1
SCHEMBL16424346 0.77 ALDH1A1 (0.39) L3MBTL1
SCHEMBL26698331 0.77 ALDH1A1 (0.42) L3MBTL1
SCHEMBL11704069 0.75 ALDH1A1 (0.44) L3MBTL1
SCHEMBL31094788 0.75 ALDH1A1 (0.44) L3MBTL1
SCHEMBL25471357 0.73 SLC6A2 (0.44) L3MBTL1
SCHEMBL9762735 0.73 ALDH1A1 (0.43) L3MBTL1

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
US-5322638-A Halophenyl substituted dioxanes HOFFMANN-LA ROCHE INC. (US) 1994-06-21 US disclosed