SCHEMBL9800982

SCHEMBL9800982

CCCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.52
▸ LGALS8 O00214 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SSTR1 P30872 1/20 0.44
▸ SSTR2 P30874 1/20 0.44
▸ SSTR4 P31391 1/20 0.44
▸ SSTR3 P32745 1/20 0.44
▸ SSTR5 P35346 1/20 0.44
▸ TACR1 P25103 1/20 0.44
▸ SELP P16109 1/20 0.44
▸ LGALS3 P17931 1/20 0.42
▸ TNF P01375 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
SCHEMBL6552389 0.90 GJB2 (0.46) SLC6A2LGALS8MAPK1SSTR1SSTR2
SCHEMBL6552394 0.90 GJB2 (0.46) SLC6A2LGALS8MAPK1SSTR1SSTR2
SCHEMBL16149142 0.88 SLC6A2 (0.47) SLC6A2LGALS8MAPK1SSTR1SSTR2
SCHEMBL20193199 0.87 SSTR4 (0.56) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL7644815 0.86 SLC6A2 (0.61) SLC6A2LGALS8LGALS3
SCHEMBL7644813 0.86 SLC6A2 (0.61) SLC6A2LGALS8LGALS3
SCHEMBL7155070 0.86 SLC6A2 (0.61) SLC6A2LGALS8LGALS3
SCHEMBL7155073 0.86 SLC6A2 (0.61) SLC6A2LGALS8LGALS3
SCHEMBL5691022 0.85 GBA1 (0.46) MAPK1SSTR1SSTR2SSTR4SSTR3
SCHEMBL20193198 0.83 LGALS3 (0.56) SLC6A2LGALS8SSTR1SSTR2SSTR4

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-4987223-A INTERMEDIATES FOR GLYCOSIDE ENZYME SUBSTRATES CHOAY S.A. (FR) 1991-01-22 — — US disclosed
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