SCHEMBL11077024

SCHEMBL11077024

CCOC(=O)C1(CCOCC2CCCCCCCCCCC2)CO1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
ABCB11 O95342 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
NAAA Q02083 1/20 0.36
SPHK1 Q9NYA1 7/20 0.34
TDP1 Q9NUW8 1/20 0.32
FFAR1 O14842 1/20 0.32
SPHK2 Q9NRA0 1/20 0.32

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
SCHEMBL11076079 0.91 NAAA (0.35) LMNAABCB11MAPTMAPK1NAAA
SCHEMBL11069034 0.90 ABCB11 (0.54) LMNAABCB11MAPTMAPK1SPHK1
SCHEMBL11022703 0.87 ABCB11 (0.43) LMNAABCB11MAPTMAPK1NAAA
SCHEMBL11070063 0.85 ABCB11 (0.46) LMNAABCB11MAPTMAPK1NAAA
SCHEMBL11073072 0.83 MAPT (0.42) LMNAABCB11MAPTMAPK1TDP1
SCHEMBL11070412 0.83 MAPT (0.42) LMNAABCB11MAPTMAPK1TDP1
SCHEMBL11219714 0.83 SLC1A3 (0.40) LMNANAAASPHK1SPHK2
SCHEMBL11078904 0.83 SLC1A3 (0.34) NAAASPHK1SPHK2
SCHEMBL11080350 0.82 ABCB11 (0.44) LMNAABCB11MAPTMAPK1SPHK1
SCHEMBL11073284 0.82 MAPT (0.46) LMNAABCB11MAPTMAPK1NAAA

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