SCHEMBL7777987

SCHEMBL7777987

Cc1cn([C@@H]2O[C@H](CO)C(OS(=O)(=O)CC(C)c3ccccc3[N+](=O)[O-])C2O)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK2 O00142 2/20 0.43
TYMP P19971 5/20 0.40
RNASE1 P07998 1/20 0.39
PYGM P11217 3/20 0.38

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
SCHEMBL7777999 0.87 P2RY6 (0.39) TK2PYGM
SCHEMBL7644575 0.85 TK2 (0.45) TK2TYMPRNASE1PYGM
SCHEMBL7777984 0.83 RNASE1 (0.55) TK2RNASE1
SCHEMBL7644973 0.80 TK2 (0.44) TK2TYMPRNASE1PYGM
SCHEMBL7644542 0.80 TK2 (0.45) TK2TYMPRNASE1
SCHEMBL6891122 0.78 P2RY6 (0.38)
SCHEMBL6891984 0.78 DNPH1 (0.38) TK2
SCHEMBL8072458 0.78 POLB (0.48)
SCHEMBL7777997 0.78 POLB (0.48)
SCHEMBL2585241 0.77 TK2 (0.55) TK2TYMPPYGM

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
EP-0901501-B1 NUCLEOSIDE DERIVATIVES WITH PHOTO-UNSTABLE PROTECTIVE GROUPS PFLEIDERER WOLFGANG (DE) 2001-10-17 EP disclosed