SCHEMBL10339463

SCHEMBL10339463

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

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 14/20 0.38
SPHK1 Q9NYA1 12/20 0.38
GBA1 P04062 2/20 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
SCHEMBL10339462 1.00 SPHK2 (0.38) SPHK2SPHK1GBA1
SCHEMBL9618622 0.84 SPHK2 (0.34) SPHK2SPHK1GBA1
SCHEMBL9618621 0.84 SPHK2 (0.34) SPHK2SPHK1GBA1
SCHEMBL19784338 0.83
SCHEMBL25424610 0.81 SPHK2 (0.39) SPHK2SPHK1
SCHEMBL31680349 0.81 SPHK2 (0.39) SPHK2SPHK1
SCHEMBL31680283 0.81 SPHK2 (0.39) SPHK2SPHK1
SCHEMBL31680306 0.81 SPHK2 (0.39) SPHK2SPHK1
SCHEMBL31680279 0.81 SPHK2 (0.39) SPHK2SPHK1
SCHEMBL31680334 0.81 SPHK2 (0.39) SPHK2SPHK1

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
JP-2223591-A None JP disclosed
JP-H02223591-A NOVEL PLATINUM COMPLEX, ANTITUMOR AGENT AND INTERMEDIATE THEREFOR HOKKO CHEM IND CO LTD 1990-09-05 JP disclosed