Sugi Predict

Sugi Predict / Compounds / SCHEMBL22288089

SCHEMBL22288089

SCHEMBL22288089

Cc1cn(C2CC(OC(=O)OCCN(Cc3ccccc3)C[C@@H]3CCCCN3C(=O)OC(C)(C)C)C(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)O2)c(=O)[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RNASE1 P07998 1/20 0.40
▸ TOP2A P11388 6/20 0.38
▸ TK1 P04183 4/20 0.35
▸ TK2 O00142 1/20 0.34
▸ HDAC1 Q13547 6/20 0.34

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
SCHEMBL30932966 1.00 RNASE1 (0.40) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL30932976 0.98 RNASE1 (0.41) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL22977548 0.96 RNASE1 (0.42) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL30932972 0.95 RNASE1 (0.38) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL20535951 0.94 RNASE1 (0.42) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL20535919 0.93 RNASE1 (0.42) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL20535923 0.93 RNASE1 (0.42) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL22288119 0.92 RNASE1 (0.40) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL22977554 0.90 RNASE1 (0.39) RNASE1TOP2ATK1TK2HDAC1
SCHEMBL30932979 0.90 RNASE1 (0.39) RNASE1TOP2ATK1TK2HDAC1

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
WO-2019145713-A9 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS EVONETIX LTD (GB) 2020-08-06 — — WO disclosed
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