SCHEMBL9547401

SCHEMBL9547401

Cc1cn([C@H]2C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COC(=O)c3ncc[nH]3)O2)c(=O)[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.49
TOP2A P11388 4/20 0.47
TK1 P04183 5/20 0.45
ABCG2 Q9UNQ0 3/20 0.44
ABCB1 P08183 1/20 0.44
TK2 O00142 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
SCHEMBL9547404 1.00 RNASE1 (0.49) RNASE1TOP2ATK1ABCG2ABCB1
SCHEMBL9547415 0.86 POLB (0.55) RNASE1TK1
SCHEMBL9547412 0.86 POLB (0.55) RNASE1TK1
SCHEMBL16494725 0.84 RNASE1 (0.64) RNASE1TOP2ATK1ABCG2ABCB1
SCHEMBL735094 0.84 TOP2A (0.53) RNASE1TOP2ATK1ABCG2ABCB1
SCHEMBL734481 0.83 TOP2A (0.51) RNASE1TOP2ATK1ABCG2ABCB1
SCHEMBL735281 0.82 RNASE1 (0.55) RNASE1TOP2ATK1ABCG2ABCB1
SCHEMBL24059082 0.82 TOP2A (0.55) RNASE1TOP2ATK1
SCHEMBL21563908 0.82 TOP2A (0.65) RNASE1TOP2ATK1
SCHEMBL1514947 0.82 TOP2A (0.65) RNASE1TOP2ATK1

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-5218102-A Easily synthesized, hybridize well with target sequences IMPROBIO (BE) 1993-06-08 US disclosed