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Sugi Predict / Compounds / SCHEMBL6852025

SCHEMBL6852025

SCHEMBL6852025

COc1ccc(C(OC[C@H]2O[C@@H](n3cc(C)c(=O)[nH]c3=O)[C@H](OCOCCOC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)[C@H](O)[C@@H]3O)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 8/20 0.53
▸ TK2 O00142 7/20 0.41
▸ P2RY6 Q15077 2/20 0.39

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
SCHEMBL6246850 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL3069438 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL13205014 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL13714472 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL15974161 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL3069436 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL9710318 0.90 TYMP (0.62) TYMPTK2P2RY6
SCHEMBL2116483 0.90 TYMP (0.47) TYMPTK2
SCHEMBL2116480 0.90 TYMP (0.47) TYMPTK2
SCHEMBL5502782 0.90 TYMP (0.51) TYMPTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1417350-A2 ANTISENSE MODULATION OF HORMONE-SENSITIVE LIPASE EXPRESSION Isis Pharmaceuticals, Inc. (US) 2004-05-12 — — EP disclosed
WO-2003010139-A2 ANTISENSE MODULATION OF HORMONE-SENSITIVE LIPASE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2003-02-06 — — WO disclosed