SCHEMBL20888304

SCHEMBL20888304

C[C@H]1OC(=O)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@@]5(C)CC[C@@H](C(C)(C)O)O5)[C@@H](O)C[C@@]2(C)C4C[C@H](O)C13

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 3/20 0.49
▸ ABCB1 P08183 2/20 0.39
▸ ABCC1 P33527 1/20 0.32
▸ ATP1A1 P05023 1/20 0.32
▸ ATP1B1 P05026 1/20 0.32
▸ ATP1A3 P13637 1/20 0.32
▸ ATP1B2 P14415 1/20 0.32
▸ ATP1A2 P50993 1/20 0.32
▸ ATP1B3 P54709 1/20 0.32
▸ FXYD2 P54710 1/20 0.32
▸ ATP1A4 Q13733 1/20 0.32
▸ PPARG P37231 1/20 0.31

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
SCHEMBL15631024 0.82 TYR (0.51) TYRABCB1ABCC1ATP1A1ATP1B1
SCHEMBL13035608 0.82 TYR (0.51) TYRABCB1ABCC1ATP1A1ATP1B1
SCHEMBL18197925 0.82 TYR (0.51) TYRABCB1ABCC1ATP1A1ATP1B1
SCHEMBL24068198 0.81 TYR (0.46) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL29732482 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL20279380 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL30836078 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL18495439 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL20888305 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3
Argentatine A SCHEMBL18495437 0.79 TYR (0.48) TYRABCB1ATP1A1ATP1B1ATP1A3

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-2019070219-A2 PRODUCTION METHOD OF TELOMERASE ACTIVATORS AND TELOMERASE ACTIVATORS OBTAINED BY THIS METHOD IZMIR YUKSEK TEKNOLOJI ENSTITUSU (TR) 2019-04-11 — — WO disclosed
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