SCHEMBL8438746

SCHEMBL8438746

COc1ccc(C(C[C@H]2O[C@@H](n3cc(C)c(=O)[nH]c3=O)CC2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.54
TYMS P04818 1/20 0.54

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
SCHEMBL8438743 1.00 TK1 (0.54) TK1TYMS
SCHEMBL22984023 0.88 TYMS (0.56) TK1TYMS
SCHEMBL2460809 0.88 TYMS (0.56) TK1TYMS
SCHEMBL14064188 0.88 TYMS (0.56) TK1TYMS
SCHEMBL22983968 0.88 TYMS (0.56) TK1TYMS
SCHEMBL22983972 0.88 TYMS (0.56) TK1TYMS
SCHEMBL7535874 0.88 TYMS (0.56) TK1TYMS
SCHEMBL23517951 0.88 TYMS (0.56) TK1TYMS
SCHEMBL2460807 0.88 TYMS (0.56) TK1TYMS
SCHEMBL1775528 0.88 TYMS (0.56) TK1TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5864031-A REACTING POLYMER SUPPORTED NUCLEOSIDE (2',5'-DIDEOXY-5'-S(4,4-DIMETHOXYTRITYL) WITH AN ACID IN PRESENCE OF ARYLSULFENYL CHLORIDE, REACTING ASYMMETRICAL DISULFIDE OF NUCLEOSIDE WITH 3'-H-PHOSPHONATE SYNTHON AMGEN INC. (US) 1999-01-26 US disclosed
EP-0772622-A1 5'-DITHIO-MODIFIED OLIGONUCLEOTIDES AMGEN INC. (US) 1997-05-14 EP disclosed
WO-1996004295-A1 5'-DITHIO-MODIFIED OLIGONUCLEOTIDES AMGEN INC. (US) 1996-02-15 WO disclosed