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Sugi Predict / Compounds / SCHEMBL30544836

SCHEMBL30544836

SCHEMBL30544836

CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@H](C)CC[C@H](O)C(C)(C)O)[C@@H](O)C[C@@]3(C)[C@@H]5C[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 4/20 0.61
▸ PSEN1 P49768 6/20 0.41
▸ PSEN2 P49810 6/20 0.41
▸ APH1B Q8WW43 6/20 0.41
▸ NCSTN Q92542 6/20 0.41
▸ APH1A Q96BI3 6/20 0.41
▸ PSENEN Q9NZ42 6/20 0.41
▸ EPHX2 P34913 3/20 0.40
▸ LMNA P02545 1/20 0.37
▸ XBP1 P17861 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PRKAG1 P54619 2/20 0.36
▸ PRKAA2 P54646 2/20 0.36
▸ PRKAB1 Q9Y478 2/20 0.36
▸ HSD11B1 P28845 1/20 0.35
▸ HSD11B2 P80365 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ CRHBP P24387 2/20 0.35

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
SCHEMBL30301229 0.97 TYR (0.60) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678803 0.94 TYR (0.65) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678767 0.94 TYR (0.66) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678813 0.93 TYR (0.61) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30190169 0.93 TYR (0.70) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL29924542 0.91 TYR (0.57) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30887921 0.91 TYR (0.66) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30190326 0.90 TYR (0.59) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678815 0.90 TYR (0.59) TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678743 0.87 TYR (0.67) TYRPSEN1PSEN2APH1BNCSTN

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250144164-A1 COMPOSITIONS, METHODS, AND MEDICAL COMPOSITIONS FOR TREATMENT OF AND MAINTAINING THE HEALTH OF THE LIVER UNIGEN, INC. (US) 2025-05-08 — — US disclosed
US-11806379-B2 Compositions, methods, and medical compositions for treatment of and maintaining the health of the liver UNIGEN, INC. (US) 2023-11-07 — — US disclosed
CN-115078561-B Separation method of chemical components in astragalus membranaceus and application thereof 天津中医药大学 2023-08-29 — — CN disclosed
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