SCHEMBL8749986

SCHEMBL8749986

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

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.68
TYMS P04818 1/20 0.44
TK1 P04183 4/20 0.43
TK2 O00142 1/20 0.43
TYMP P19971 1/20 0.42

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
SCHEMBL9015805 0.93 RNASE1 (0.59) RNASE1TYMSTK1TK2TYMP
SCHEMBL23045153 0.93 RNASE1 (0.57) RNASE1TYMSTK1TK2TYMP
SCHEMBL9015761 0.93 RNASE1 (0.59) RNASE1TYMSTK1TK2
SCHEMBL5531136 0.92 RNASE1 (0.56) RNASE1TYMSTK1TK2TYMP
SCHEMBL2379935 0.92 RNASE1 (0.56) RNASE1TYMSTK1TK2TYMP
SCHEMBL5531135 0.92 RNASE1 (0.56) RNASE1TYMSTK1TK2TYMP
SCHEMBL6830771 0.90 RNASE1 (0.51) RNASE1TYMSTK1TYMP
SCHEMBL30287884 0.89 RNASE1 (0.53) RNASE1TYMSTK1
SCHEMBL23996825 0.89 RNASE1 (0.53) RNASE1TYMSTK1
SCHEMBL5402296 0.89 RNASE1 (0.53) RNASE1TYMSTK1

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
EP-0611373-B1 OLIGO-2'-DEOXYNUCLEOTIDES AND THEIR USE AS DRUGS WITH AN ANTIVIRAL ACTION BOEHRINGER MANNHEIM GMBH (DE) 1997-03-26 EP disclosed