SCHEMBL25101159

SCHEMBL25101159

O=C(OC1C(O)C(O)C(CO)OC1n1ccc2ccccc21)c1ccc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 3/20 0.40
▸ RPS6KA3 P51812 3/20 0.40
▸ MAPK14 Q16539 3/20 0.40
▸ SLC28A1 O00337 1/20 0.39
▸ SLC28A2 O43868 1/20 0.39
▸ SLC29A1 Q99808 1/20 0.39
▸ SLC28A3 Q9HAS3 1/20 0.39
▸ LGALS9 O00182 4/20 0.38
▸ LGALS1 P09382 4/20 0.38
▸ LGALS3 P17931 4/20 0.38
▸ LGALS7; LGALS7B P47929 4/20 0.38
▸ LGALS8 O00214 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ MDM2 Q00987 1/20 0.38
▸ NCOA1 Q15788 1/20 0.38
▸ NCOA3 Q9Y6Q9 1/20 0.38
▸ CD69 Q07108 1/20 0.37
▸ TK2 O00142 1/20 0.37

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
SCHEMBL30295293 0.88 ADORA1 (0.39) GSK3ARPS6KA3MAPK14LGALS9LGALS1
SCHEMBL25100805 0.85 LGALS9 (0.53) SLC28A1SLC28A2SLC29A1SLC28A3LGALS9
SCHEMBL30295326 0.83 TK2 (0.36) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL25100803 0.81 LGALS9 (0.45) SLC28A1SLC28A2SLC29A1SLC28A3LGALS9
SCHEMBL23982553 0.76 LMNA (0.56) SLC28A1SLC28A2SLC29A1SLC28A3LMNA
SCHEMBL4141706 0.76 LMNA (0.56) SLC28A1SLC28A2SLC29A1SLC28A3LMNA
SCHEMBL2981353 0.76 LMNA (0.56) SLC28A1SLC28A2SLC29A1SLC28A3LMNA
SCHEMBL20419148 0.76 LMNA (0.56) SLC28A1SLC28A2SLC29A1SLC28A3LMNA
SCHEMBL219357 0.74 LMNA (0.54) SLC28A1SLC28A2SLC29A1SLC28A3LMNA
SCHEMBL155587 0.74 LMNA (0.54) SLC28A1SLC28A2SLC29A1SLC28A3LMNA

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-2023028350-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2023-03-02 — — WO disclosed
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