SCHEMBL20862256

SCHEMBL20862256

OCCN1CC[C@@H](O)C[C@H]1CO

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 17/20 0.39
SPHK2 Q9NRA0 15/20 0.38
AGL P35573 1/20 0.37
GAA P10253 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MGAM O43451 1/20 0.36
GBA1 P04062 1/20 0.36
LCT P09848 1/20 0.36
SI P14410 1/20 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
SCHEMBL23913040 1.00 SPHK1 (0.39) SPHK1SPHK2AGLGAATDP1
SCHEMBL23912945 0.85 GBA1 (0.50) SPHK1SPHK2GAAGBA1
SCHEMBL20726262 0.85 GBA1 (0.50) SPHK1SPHK2GAAGBA1
SCHEMBL19512642 0.82 GBA2 (0.53) SPHK1SPHK2AGLGAAMGAM
SCHEMBL23517199 0.82 GBA2 (0.53) SPHK1SPHK2AGLGAAMGAM
SCHEMBL20726313 0.80 SPHK1 (0.37) SPHK1SPHK2GAAGBA1
SCHEMBL20726306 0.80 SPHK1 (0.37) SPHK1SPHK2GAAGBA1
SCHEMBL9656350 0.79 AGL (0.44) SPHK1SPHK2AGLGAATDP1
SCHEMBL9656346 0.79 AGL (0.44) SPHK1SPHK2AGLGAATDP1
SCHEMBL23996474 0.79 SPHK1 (0.43) SPHK1SPHK2GBA1

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
WO-2023138099-A1 PREPARATION METHOD FOR MIGLITTOL 浙江奥翔药业股份有限公司 2023-07-27 WO disclosed
EP-3461812-A1 N-(5-(BIPHEN-4-YLMETHYLOXY)PENTYL)-SUBSTITUTED IMINOSUGARS AS INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE Academisch Medisch Centrum (NL) 2019-04-03 EP disclosed