SCHEMBL8654707

SCHEMBL8654707

CC(C)N(C(C)C)P(O)OCCC#N.Cc1cn([C@H]2C[C@H](O)[C@@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)O2)c(=O)[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYMP P19971 1/20 0.46
TK1 P04183 2/20 0.45
POLB P06746 1/20 0.44
BCHE P06276 1/20 0.43

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
SCHEMBL8655477 0.88 DUT (0.51)
SCHEMBL8658996 0.88 TK1 (0.44) TK1
Doxribtimine SCHEMBL8742401 0.86 TK1 (0.51) TK1
SCHEMBL8654714 0.85 RNASE1 (0.43) TYMPTK1
SCHEMBL8658998 0.84 RNASE1 (0.41) TK1
SCHEMBL1727537 0.84 POLB (0.58) TYMPTK1POLBBCHE
SCHEMBL1727320 0.84 POLB (0.58) TYMPTK1POLBBCHE
SCHEMBL10446716 0.84 POLB (0.58) TYMPTK1POLBBCHE
SCHEMBL6334503 0.84 POLB (0.58) TYMPTK1POLBBCHE
SCHEMBL5053953 0.84 POLB (0.58) TYMPTK1POLBBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5807837-A ADMINISTERING TO TREAT HIV INFECTIONS TO INHIBIT THE REPLICATION OF FOREIGN NUCLEIC ACIDS IN A NORMAL CELL SANKYO COMPANY, LIMITED (JP) 1998-09-15 US disclosed
US-5674856-A TREATMENT AND PROPHYLAXIS OF VIRAL INFECTIONS, INCLUDING AIDS AND TUMORS SANKYO COMPANY, LIMITED (JP) 1997-10-07 US disclosed
EP-0611075-B1 Modified oligodeoxyribonucleotides, their preparation and their therapeutic use SANKYO CO (JP) 1996-12-18 EP disclosed
EP-0611075-A1 Modified oligodeoxyribonucleotides, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-08-17 EP disclosed