SCHEMBL6065320

SCHEMBL6065320

Cc1cn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](O)[C@H]2O)c(=O)nc1N

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYMP P19971 14/20 0.56
ADORA1 P30542 2/20 0.49
P2RY6 Q15077 1/20 0.47

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
SCHEMBL5954788 0.94 TYMP (0.61) TYMPADORA1P2RY6
SCHEMBL7651830 0.84 TYMP (0.60) TYMPADORA1
SCHEMBL261566 0.83 TYMP (0.50) TYMPADORA1P2RY6
SCHEMBL7261556 0.83 TYMP (0.50) TYMPADORA1P2RY6
SCHEMBL5038377 0.83 ALDH1A1 (0.62) P2RY6
SCHEMBL11430667 0.83 LMNA (0.64) TYMP
SCHEMBL11796922 0.83 LMNA (0.64) TYMP
SCHEMBL234387 0.82 LMNA (0.46) P2RY6
SCHEMBL1684799 0.82 ADK (0.52) P2RY6
SCHEMBL21998920 0.82 ADK (0.52) P2RY6

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-1648910-A2 ANTISENSE MODULATION OF STEAROYL-COA DESATURASE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2006-04-26 EP disclosed
WO-2005014607-A2 ANTISENSE MODULATION OF STEAROYL-COA DESATURASE EXPRESSION ISIS PHARMACEUTICALS INC. (US) 2005-02-17 WO disclosed