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SCHEMBL8930456

SCHEMBL8930456

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)n(C(=O)C(C)C)c(N)nc43)[C@H](F)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 10/20 0.58
▸ NT5E P21589 10/20 0.49

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
SCHEMBL21356487 0.83 TYMP (0.76) TYMPNT5E
SCHEMBL1895609 0.82 TYMP (0.60) TYMPNT5E
SCHEMBL1895610 0.82 TYMP (0.60) TYMPNT5E
SCHEMBL30262593 0.81 NT5E (0.67) NT5E
SCHEMBL19949285 0.81 NT5E (0.67) NT5E
SCHEMBL8355197 0.81 TYMP (0.58) TYMPNT5E
SCHEMBL18797904 0.81 TYMP (0.60) TYMPNT5E
SCHEMBL20548084 0.81 TYMP (0.61) TYMPNT5E
SCHEMBL29799117 0.80 NT5E (0.65) TYMPNT5E
SCHEMBL12642132 0.79 TYMP (0.57) TYMPNT5E

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
EP-0549615-A4 SUGAR MODIFIED OLIGONUCLEOTIDES THAT DETECT AND MODULATE GENE EXPRESSION ISIS PHARMACEUTICALS INC (US) 1997-08-27 — — EP disclosed
EP-0549615-A1 SUGAR MODIFIED OLIGONUCLEOTIDES THAT DETECT AND MODULATE GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1993-07-07 — — EP disclosed
WO-1992003568-A1 SUGAR MODIFIED OLIGONUCLEOTIDES THAT DETECT AND MODULATE GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1992-03-05 — — WO disclosed