SCHEMBL31154034

SCHEMBL31154034

CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO[C@H]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO)O[C@H]1O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 5/20 0.56
▸ LGALS8 O00214 1/20 0.56
▸ LGALS4 P56470 1/20 0.56
▸ CD209 Q9NNX6 2/20 0.56
▸ ENGASE Q8NFI3 1/20 0.53
▸ AMY2A P04746 2/20 0.46
▸ MAPK1 P28482 2/20 0.45
▸ CD69 Q07108 1/20 0.45
▸ CHIA Q9BZP6 1/20 0.45
▸ LGALS1 P09382 1/20 0.44
▸ LGALS7; LGALS7B P47929 1/20 0.44
▸ HPSE Q9Y251 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41

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
SCHEMBL29383063 1.00 LGALS3 (0.56) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29407248 1.00 LGALS3 (0.56) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL12871588 1.00 LGALS3 (0.56) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29510709 1.00 LGALS3 (0.56) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29370195 0.99 LGALS3 (0.57) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL30532206 0.99 LGALS3 (0.57) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29665054 0.99 LGALS3 (0.57) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29737501 0.99 LGALS3 (0.57) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL29367524 0.99 LGALS3 (0.57) LGALS3LGALS8LGALS4CD209ENGASE
SCHEMBL30943987 0.98 LGALS3 (0.56) LGALS3LGALS8LGALS4CD209ENGASE

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
WO-2024220354-A1 METHODS OF PRODUCING HIV-1 ENVELOPE GLYCOPROTEINS AND GUANOSINE MICROPARTICLES THEREOF PUERTO RICO SCIENCE TECHNOLOGY & RESEARCH TRUST (PR) 2024-10-24 — — WO disclosed
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