SCHEMBL16704350

SCHEMBL16704350

Cc1cn([C@H]2C[C@@H](ON3C(=O)c4ccccc4C3=O)[C@@H](COP(C)C)O2)c(=O)[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RNASE1 P07998 1/20 0.55
▸ TK1 P04183 6/20 0.47
▸ TK2 O00142 2/20 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
SCHEMBL16704357 0.91 RNASE1 (0.56) RNASE1TK1TK2
SCHEMBL25752670 0.88 RNASE1 (0.59) RNASE1TK1TK2
SCHEMBL1334035 0.87 RNASE1 (0.71) RNASE1TK1TK2
SCHEMBL7922859 0.87 RNASE1 (0.58) RNASE1TK1TK2
SCHEMBL7922857 0.87 RNASE1 (0.58) RNASE1TK1TK2
SCHEMBL1334032 0.87 RNASE1 (0.71) RNASE1TK1TK2
SCHEMBL16704351 0.87 RNASE1 (0.71) RNASE1TK1TK2
SCHEMBL3912314 0.85 RNASE1 (0.54) RNASE1TK1TK2
SCHEMBL3912309 0.85 RNASE1 (0.54) RNASE1TK1TK2
SCHEMBL4578740 0.85 TOP2A (0.58) 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
US-9029346-B1 Irreversible inhibitors of DNA polymerase beta THE JOHNS HOPKINS UNIVERSITY (US) 2015-05-12 — — US disclosed
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