SCHEMBL11069034

SCHEMBL11069034

CCOC(=O)C1(CCCCCCOCC2CCCC2)CO1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
MAPK1 P28482 1/20 0.54
SPHK1 Q9NYA1 12/20 0.39
SPHK2 Q9NRA0 4/20 0.36

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
SCHEMBL11077024 0.90 LMNA (0.42) ABCB11LMNAMAPTMAPK1SPHK1
SCHEMBL11080350 0.88 ABCB11 (0.44) ABCB11LMNAMAPTMAPK1SPHK1
SCHEMBL11073420 0.87 ABCB11 (0.51) ABCB11LMNAMAPTMAPK1
SCHEMBL11077144 0.86 ABCB11 (0.50) ABCB11LMNAMAPTMAPK1
SCHEMBL11073550 0.86 ABCB11 (0.53) ABCB11LMNAMAPTMAPK1
SCHEMBL11071660 0.86 ABCB11 (0.50) ABCB11LMNAMAPTMAPK1
SCHEMBL11070066 0.86 SPHK1 (0.44) ABCB11LMNAMAPTMAPK1SPHK1
SCHEMBL11076754 0.85 ABCB11 (0.51) ABCB11LMNAMAPTMAPK1
SCHEMBL11073753 0.85 ABCB11 (0.51) ABCB11LMNAMAPTMAPK1
SCHEMBL11080379 0.84 ABCB11 (0.50) ABCB11LMNAMAPTMAPK1

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
US-4430339-A PROPHYLAXIS, METABOLISM, GLUCOSE, FATS, HYPOGLYCEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 US disclosed
WO-1982000822-A1 SUBSTITUTED OXIRANECARBOXYLIC ACIDS,THEIR PREPARATION AND THEIR USE AS MEDICAMENTS EISTETTER K 1982-03-18 WO disclosed