SCHEMBL30396378

SCHEMBL30396378

[2H]C(O)[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1OC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.54
TK1 P04183 3/20 0.46
TK2 O00142 2/20 0.46
LMNA P02545 2/20 0.45
TSHR P16473 2/20 0.45
ALB P02768 1/20 0.45
PKM P14618 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
CYP2D6 P10635 1/20 0.45
TYMS P04818 1/20 0.45

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
SCHEMBL25400848 0.93 RNASE1 (0.63) RNASE1TK1TK2
SCHEMBL25764517 0.93 RNASE1 (0.63) RNASE1TK1TK2
SCHEMBL4808054 0.93 RNASE1 (0.63) RNASE1TK1TK2
SCHEMBL25399868 0.93 RNASE1 (0.63) RNASE1TK1TK2
SCHEMBL4808051 0.93 RNASE1 (0.63) RNASE1TK1TK2
SCHEMBL6323173 0.89 RNASE1 (0.51) RNASE1TK1TK2TYMS
SCHEMBL8859632 0.87 RNASE1 (0.49) RNASE1TK1TYMS
SCHEMBL6830424 0.87 RNASE1 (0.49) RNASE1TK1TK2TYMS
SCHEMBL6320524 0.87 RNASE1 (0.70) RNASE1TK1TK2LMNATSHR
SCHEMBL25395896 0.85 TOP2A (0.56) RNASE1TK1TK2

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
CN-116063365-A Method for preparing oligonucleotide and nucleoside, nucleotide or oligonucleotide 味之素株式会社 2023-05-05 CN disclosed