SCHEMBL11110342

SCHEMBL11110342

CCCCCCCCCCCCCCCCCCO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 6/20 0.50
▸ ALDH1A1 P00352 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SPHK2 Q9NRA0 1/20 0.43
▸ SPHK1 Q9NYA1 1/20 0.43
▸ MAPK1 P28482 1/20 0.41
▸ GUSB P08236 2/20 0.40
▸ GBA2 Q9HCG7 6/20 0.39

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
SCHEMBL11108682 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL11098588 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL15618283 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL15618295 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL11110339 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL15618347 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL15618344 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL11098591 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL15618294 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1
SCHEMBL11097755 1.00 GBA1 (0.50) GBA1ALDH1A1TDP1SPHK2SPHK1

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-4454123-A ANTICOAGULANTS, ANTITUMOR AGENTS SEIKAGAKU KOGYO CO. LTD. (JP) 1984-06-12 — — US disclosed
Send feedback