SCHEMBL7995787

SCHEMBL7995787

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

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.39
TK2 O00142 10/20 0.38
TYMP P19971 1/20 0.36
RNASE1 P07998 1/20 0.36

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
SCHEMBL6830770 0.85 TK2 (0.43) TK1TK2TYMPRNASE1
SCHEMBL6827415 0.84 TK2 (0.45) TK1TK2RNASE1
SCHEMBL6323179 0.83 TK2 (0.42) TK1TK2TYMPRNASE1
SCHEMBL6831419 0.83 TK1 (0.38) TK1TK2TYMP
SCHEMBL6831414 0.83 TK1 (0.38) TK1TK2TYMP
SCHEMBL6832155 0.83 TK2 (0.42) TK1TK2TYMPRNASE1
SCHEMBL6830104 0.82 TK1 (0.34) TK1TK2TYMPRNASE1
SCHEMBL6831283 0.82 TK2 (0.41) TK1TK2TYMPRNASE1
SCHEMBL6830086 0.82 TK1 (0.34) TK1TK2TYMPRNASE1
SCHEMBL8987793 0.81 TK2 (0.41) TK1TK2TYMPRNASE1

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
US-6121437-A SYNTHESIS OF OLIGONUCLEOTIDES USING OLIGONUCLEOTIDES OR NUCLEOTIDES WITH PROTECTED INTERNUCLEOSIDIC PHOSPHORUS FUNCTIONALITIES WHICH CAN BE REMOVED UNDER MILD CONDITIONS AND PRODUCE NONTOXIC BY-PRODUCTS ISIS PHARMACEUTICALS, INC. (US) 2000-09-19 US disclosed