SCHEMBL19261576

SCHEMBL19261576

CC(C)(O[C@@H]1[C@@H](O)[C@H](C(C)(C)O[C@@H]2[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]2O)O[C@H](CO)[C@H]1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ SLC2A1 P11166 1/20 0.38
▸ MAPK1 P28482 1/20 0.36
▸ LGALS1 P09382 2/20 0.36
▸ LGALS3 P17931 2/20 0.36
▸ LGALS9 O00182 1/20 0.36
▸ LGALS8 O00214 1/20 0.36
▸ PYGB P11216 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL19261577 1.00 L3MBTL1 (0.44) L3MBTL1MAPTSLC2A1MAPK1LGALS1
SCHEMBL19682226 0.80 IGF2R (0.47) L3MBTL1MAPTLGALS3LGALS8ALDH1A1
SCHEMBL19682225 0.80 IGF2R (0.47) L3MBTL1MAPTLGALS3LGALS8ALDH1A1
SCHEMBL24205791 0.80 L3MBTL1 (0.44) L3MBTL1MAPTSLC2A1MAPK1LGALS1
SCHEMBL24205805 0.80 L3MBTL1 (0.44) L3MBTL1MAPTSLC2A1MAPK1LGALS1
SCHEMBL19966790 0.79 L3MBTL1 (0.42) L3MBTL1MAPTLGALS1LGALS3LGALS9
SCHEMBL23640150 0.79 L3MBTL1 (0.42) L3MBTL1MAPTLGALS1LGALS3LGALS9
SCHEMBL23639953 0.77 L3MBTL1 (0.40) L3MBTL1MAPTMAPK1LGALS1LGALS3
SCHEMBL18862101 0.73 L3MBTL1 (0.45) L3MBTL1MAPTLGALS1LGALS3LGALS9
SCHEMBL24824209 0.72 L3MBTL1 (0.49) L3MBTL1MAPTLGALS1LGALS3LGALS9

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-9738731-B2 Lactic acid bacterium growth enhancer, regulatory T-cell number increasing agent, method of enhancing growth of lactic acid bacterium, method of increasing number of regulatory T-cells, method of evaluating regulatory T-cell number increasing effect, and method of evaluating lactic acid growth enhancing effect TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2017-08-22 — — US disclosed
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