SCHEMBL8535403

SCHEMBL8535403

Cc1cn([C@H]2O[C@@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)C(O)C2O)c(=O)[nH]c1=O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYMP P19971 10/20 0.57
TK2 O00142 4/20 0.49
TK1 P04183 3/20 0.48

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
SCHEMBL5953147 1.00 TYMP (0.57) TYMPTK2TK1
SCHEMBL8535399 1.00 TYMP (0.57) TYMPTK2TK1
SCHEMBL4626083 1.00 TYMP (0.57) TYMPTK2TK1
SCHEMBL13205014 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL3069436 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL9710318 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL3069438 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL13714472 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL15974161 0.94 TYMP (0.62) TYMPTK2TK1
SCHEMBL6246850 0.94 TYMP (0.62) TYMPTK2TK1

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-0682670-B1 DEOXYGENATION OF CIS VICINAL DIOLS RAYLO CHEMICALS INC (CA) 1998-05-06 EP claimed
US-5410033-A Deoxygenation of cis vicinal diols to make didehydro dideoxy nucleosidies and synthetic intermediates TEROCHEM LABORATORIES LIMITED (CA) 1995-04-25 US claimed
EP-0682670-B1 DEOXYGENATION OF CIS VICINAL DIOLS RAYLO CHEMICALS INC (CA) 1998-05-06 EP disclosed
EP-0682670-A1 DEOXYGENATION OF CIS VICINAL DIOLS RAYLO CHEMICALS INC. (CA) 1995-11-22 EP disclosed
US-5410033-A Deoxygenation of cis vicinal diols to make didehydro dideoxy nucleosidies and synthetic intermediates TEROCHEM LABORATORIES LIMITED (CA) 1995-04-25 US disclosed
WO-1994018214-A1 DEOXYGENATION OF CIS VICINAL DIOLS TEROCHEM LABORATORIES LIMITED (CA) 1994-08-18 WO disclosed