SCHEMBL11117544

SCHEMBL11117544

CCCCCCCC1OC[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 11/20 0.69
SPHK1 Q9NYA1 10/20 0.69
ALDH1A1 P00352 1/20 0.50
GBA1 P04062 3/20 0.47
GUSB P08236 3/20 0.46

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
SCHEMBL11241003 1.00 SPHK2 (0.69) SPHK2SPHK1ALDH1A1GBA1GUSB
SCHEMBL11117820 1.00 SPHK2 (0.69) SPHK2SPHK1ALDH1A1GBA1GUSB
SCHEMBL11114512 1.00 SPHK2 (0.69) SPHK2SPHK1ALDH1A1GBA1GUSB
SCHEMBL11243843 1.00 SPHK2 (0.69) SPHK2SPHK1ALDH1A1GBA1GUSB
SCHEMBL11275646 0.92 SPHK2 (0.58) SPHK2SPHK1ALDH1A1GBA1
Nitric Acid SCHEMBL11105222 0.85 SPHK2 (0.56) SPHK2SPHK1ALDH1A1GBA1GUSB
SCHEMBL24894219 0.84 SPHK2 (0.47) SPHK2SPHK1GBA1
SCHEMBL11083925 0.84 SPHK2 (0.47) SPHK2SPHK1GBA1
SCHEMBL22508040 0.84 SPHK2 (0.47) SPHK2SPHK1GBA1
SCHEMBL18789225 0.82 ALDH1A1 (0.58) SPHK2SPHK1ALDH1A1GBA1

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
EP-0118676-A1 D-Xylopyranoside series compounds and therapeutical compositions containing same Seikagaku Kogyo Co. Ltd. (JP) 1984-09-19 EP disclosed