SCHEMBL26130199

SCHEMBL26130199

Cc1ccc(C(=O)O[C@H]2[C@H](OCc3ccccc3)O[C@H](CO)[C@H](O)[C@@H]2O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.55
▸ LGALS9 O00182 4/20 0.55
▸ LGALS1 P09382 4/20 0.55
▸ LGALS4 P56470 4/20 0.55
▸ LGALS7; LGALS7B P47929 3/20 0.49
▸ LGALS8 O00214 2/20 0.48
▸ SLC6A2 P23975 1/20 0.46
▸ MAOB P27338 1/20 0.45
▸ NT5E P21589 1/20 0.45
▸ SLC5A2 P31639 1/20 0.44
▸ SELP P16109 1/20 0.43
▸ SYNJ2 O15056 1/20 0.43

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
SCHEMBL18114326 0.92 LGALS3 (0.57) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL9778035 0.84 LGALS8 (0.53) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL9778036 0.84 LGALS8 (0.53) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL20411239 0.83 MAOB (0.53) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15965621 0.83 LGALS3 (0.45) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL15952811 0.81 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL15952812 0.81 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL23488412 0.81 LGALS8 (0.53) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL23488417 0.81 LGALS8 (0.53) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B
SCHEMBL23488143 0.81 LGALS8 (0.53) LGALS3LGALS9LGALS1LGALS4LGALS7; LGALS7B

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-2023191088-A1 PLANT-DERIVED ORGANOCATALYST 協和ファーマケミカル株式会社 2023-10-05 — — WO disclosed
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