SCHEMBL7770718

SCHEMBL7770718

COC(=O)CCCCCCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 2/20 0.50
▸ SLC6A2 P23975 1/20 0.46
▸ SELP P16109 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ GBA1 P04062 1/20 0.43
▸ LGALS3 P17931 2/20 0.42
▸ TACR1 P25103 1/20 0.42
▸ SSTR1 P30872 1/20 0.42
▸ SSTR2 P30874 1/20 0.42
▸ SSTR4 P31391 1/20 0.42
▸ SSTR3 P32745 1/20 0.42
▸ SSTR5 P35346 1/20 0.42

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
SCHEMBL9798180 0.92 LGALS8 (0.55) LGALS8SLC6A2SELPLGALS3TACR1
SCHEMBL9798186 0.92 LGALS8 (0.55) LGALS8SLC6A2SELPLGALS3TACR1
SCHEMBL21537926 0.90 LGALS8 (0.49) LGALS8SLC6A2SELPLGALS3TACR1
SCHEMBL9797842 0.85 LGALS8 (0.43) LGALS8SELPMAPK1LGALS3TACR1
SCHEMBL9797837 0.85 LGALS8 (0.43) LGALS8SELPMAPK1LGALS3TACR1
SCHEMBL7572141 0.84 SSTR1 (0.49) LGALS8LGALS3TACR1SSTR1SSTR2
SCHEMBL7572138 0.84 SSTR1 (0.49) LGALS8LGALS3TACR1SSTR1SSTR2
SCHEMBL16062798 0.84 LGALS8 (0.45) LGALS8SLC6A2SELPTACR1SSTR1
SCHEMBL9702895 0.82 LGALS3 (0.52) LGALS8SELPMAPK1GBA1LGALS3
SCHEMBL7566502 0.81 LGALS8 (0.45) LGALS8SLC6A2SELPMAPK1LGALS3

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
EP-0837867-B1 MODIFIED ALPHA-D-Glcp-(1-2)-ALPHA-D-Glcp-(1-3)-ALPHA-D-Glcp-ANALOGUES ALBERTA RES COUNCIL (CA) 2001-08-16 — — EP disclosed
US-5929037-A GLUCOSIDASE I INHIBITORS ALBERTA RESEARCH COUNCIL (CA) 1999-07-27 — — US disclosed
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