SCHEMBL8968952

SCHEMBL8968952

CCCCC(OCc1ccccc1)N1C[C@H](O)[C@@H](O)[C@@H]1CO

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.46
GBA1 P04062 8/20 0.45
GBA2 Q9HCG7 7/20 0.44
UGCG Q16739 6/20 0.44
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
LCT P09848 2/20 0.39
SI P14410 2/20 0.39
MGAM O43451 1/20 0.39
PYGL P06737 1/20 0.38

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
SCHEMBL1389099 0.71 CYP1A2 (0.41)
SCHEMBL131141 0.68 POLB (0.42)
SCHEMBL3338742 0.68 CETP (0.44)
SCHEMBL2354118 0.68 GBA2 (0.48) GAAGBA1GBA2UGCGLCT
SCHEMBL30524953 0.67 CETP (0.42)
SCHEMBL27811490 0.67 CYP1A2 (0.39)
SCHEMBL7228777 0.67 DPP4 (0.42)
SCHEMBL6679829 0.66 CTSK (0.43)
SCHEMBL7912849 0.66 GBA1 (0.72) GAAGBA1GBA2UGCGMGAM
SCHEMBL7911357 0.66 GBA1 (0.72) GAAGBA1GBA2UGCGMGAM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0367747-B1 Dideoxy-L-arabinitol derivatives as antiviral compounds SEARLE & CO (US) 1996-03-13 EP disclosed
US-4973602-A N-ARYL DERIVATIVE OF 1,4-DIDEOXY-1,4-IMINO-L-ARAINITOL G. D. SEARLE & CO. (US) 1990-11-27 US disclosed
EP-0367747-A2 Dideoxy-L-arabinitol derivatives as antiviral compounds G.D. Searle & Co. (US) 1990-05-09 EP disclosed