SCHEMBL28282990

SCHEMBL28282990

COC1(C(c2ccccc2)(c2ccccc2)c2ccccc2)[C@H](O)[C@@H](CO)O[C@@]1(N)n1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.38
TK2 O00142 7/20 0.37
TK1 P04183 7/20 0.37
HPGD P15428 1/20 0.35

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
SCHEMBL1706308 0.81 RNASE1 (0.39) RNASE1TK2TK1HPGD
SCHEMBL6756344 0.78 RNASE1 (0.37) RNASE1TK2TK1HPGD
SCHEMBL7640426 0.78 RNASE1 (0.39) RNASE1TK2TK1
SCHEMBL9755149 0.77 RNASE1 (0.39) RNASE1TK2TK1HPGD
SCHEMBL9755162 0.75 RNASE1 (0.37) RNASE1TK2TK1
SCHEMBL6753657 0.75 TK1 (0.38) RNASE1TK2TK1
SCHEMBL1727535 0.75 RNASE1 (0.40) RNASE1TK2TK1
SCHEMBL6301637 0.75 RNASE1 (0.37) RNASE1TK2TK1
SCHEMBL8200498 0.74 RNASE1 (0.40) RNASE1TK2TK1
SCHEMBL8200495 0.74 RNASE1 (0.40) RNASE1TK2TK1

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-109477111-A THERMOSTABLE POLYMERASE INHIBITOR COMPOSITIONS AND METHODS 塞弗德公司 2019-03-15 CN disclosed