SCHEMBL8658996

SCHEMBL8658996

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

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.44

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
SCHEMBL8654707 0.88 TYMP (0.46) TK1
SCHEMBL8655477 0.88 DUT (0.51)
Doxribtimine SCHEMBL8742401 0.86 TK1 (0.51) TK1
SCHEMBL8742287 0.84 TK1 (0.42) TK1
SCHEMBL8742404 0.84 TK1 (0.40) TK1
SCHEMBL8658998 0.84 RNASE1 (0.41) TK1
SCHEMBL1883691 0.83 TK1 (0.55) TK1
SCHEMBL1883689 0.83 TK1 (0.55) TK1
SCHEMBL2594574 0.82 RNASE1 (0.39) TK1
SCHEMBL8742416 0.80 POLB (0.51) TK1

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
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