SCHEMBL6751815

SCHEMBL6751815

CCc1cn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccc(OC)cc3)c3ccc(OC)cc3)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYMP P19971 12/20 0.62
DNPH1 O43598 1/20 0.48
TK1 P04183 1/20 0.43
P2RY6 Q15077 3/20 0.43
P2RY14 Q15391 1/20 0.43
P2RY2 P41231 1/20 0.42

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
SCHEMBL3069436 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL13714472 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL6246850 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL9710318 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL3069438 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL13205014 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL15974161 0.90 TYMP (0.62) TYMPTK1P2RY6P2RY14
SCHEMBL8197884 0.90 TYMP (0.62) TYMPP2RY6P2RY14P2RY2
SCHEMBL8534788 0.90 TYMP (0.62) TYMPP2RY6P2RY14
SCHEMBL8534790 0.90 TYMP (0.62) TYMPP2RY6P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419169-A1 ANTISENSE MODULATION OF COREST EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2004-05-19 EP disclosed
EP-1417216-A2 ANTISENSE MODULATION OF BCL2-ASSOCIATED X PROTEIN EXPRESSION ISIS Pharmaceuticals, Inc. (US) 2004-05-12 EP disclosed
EP-1290204-A1 ANTISENSE MODULATION OF C/EBP ALPHA EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2003-03-12 EP disclosed
WO-2003011890-A1 ANTISENSE MODULATION OF COREST EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2003-02-13 WO disclosed
WO-2003008543-A2 ANTISENSE MODULATION OF BCL2-ASSOCIATED X PROTEIN EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2003-01-30 WO disclosed
WO-2001096586-A1 ANTISENSE MODULATION OF C/EBP ALPHA EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2001-12-20 WO disclosed