SCHEMBL29092823

SCHEMBL29092823

COc1ccc(O[C@@H]2O[C@H](COCc3ccccc3)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OCc4ccc5ccccc5c4)[C@H]3O)[C@H](OCc3ccccc3)[C@H]2N2C(O)c3ccccc3C2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SSTR5 P35346 10/20 0.44
▸ GJA1 P17302 2/20 0.43
▸ GJB2 P29033 2/20 0.43
▸ SSTR4 P31391 5/20 0.43
▸ SLC6A2 P23975 1/20 0.41
▸ SSTR3 P32745 6/20 0.39
▸ SSTR2 P30874 4/20 0.39
▸ SSTR1 P30872 2/20 0.39
▸ LGALS3 P17931 2/20 0.38

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
SCHEMBL29092821 1.00 SSTR5 (0.44) SSTR5GJA1GJB2SSTR4SLC6A2
SCHEMBL29092446 0.93 SSTR5 (0.42) SSTR5GJA1GJB2SSTR4SLC6A2
SCHEMBL29092818 0.92 SSTR5 (0.41) SSTR5GJA1GJB2SSTR4
SCHEMBL29092814 0.92 SSTR5 (0.41) SSTR5GJA1GJB2SSTR4
SCHEMBL29249623 0.90 GJB2 (0.49) GJA1GJB2SLC6A2
SCHEMBL26100760 0.88 LGALS3 (0.49) SSTR5GJA1GJB2SSTR4SLC6A2
SCHEMBL26100756 0.88 LGALS3 (0.49) SSTR5GJA1GJB2SSTR4SLC6A2
SCHEMBL29092237 0.87 GJB2 (0.45) GJA1GJB2SLC6A2
SCHEMBL29092765 0.86 GJB2 (0.41) SSTR5GJA1GJB2SSTR4SSTR3
SCHEMBL29092661 0.86 GJB2 (0.41) SSTR5GJA1GJB2SSTR4SSTR3

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
CN-118302451-A Novel oligosaccharide, intermediate for producing the oligosaccharide, and process for producing the same 第一三共株式会社 2024-07-05 — — CN disclosed
CN-116917341-A Sugar chain and method for producing pharmaceutical product containing sugar chain 第一三共株式会社 2023-10-20 — — CN disclosed
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