SCHEMBL23523713

SCHEMBL23523713

CC#Cc1cn([C@H]2C[C@H](O)[C@@H](COP(N)O)O2)c(=O)nc1N

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 6/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ DNMT3B Q9UBC3 2/20 0.39
▸ TYMS P04818 1/20 0.37
▸ FPR2 P25090 1/20 0.37

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
SCHEMBL23523712 0.88 DNMT1 (0.53) DNMT1ADRB1DNMT3BFPR2
SCHEMBL3471801 0.86 TYMS (0.52) POLBTYMS
SCHEMBL5983084 0.86 DNMT1 (0.57) DNMT1ADRB1DNMT3BFPR2
SCHEMBL5983092 0.86 DNMT1 (0.57) DNMT1ADRB1DNMT3BFPR2
SCHEMBL25492471 0.86 DNMT1 (0.57) DNMT1ADRB1DNMT3BFPR2
SCHEMBL442211 0.86 DNMT1 (0.57) DNMT1ADRB1DNMT3BFPR2
SCHEMBL149389 0.86 DNMT1 (0.57) DNMT1ADRB1DNMT3BFPR2
SCHEMBL6397616 0.85 DNMT1 (0.46) DNMT1ADRB1POLBDNMT3BFPR2
SCHEMBL17204631 0.82 DNMT1 (0.53) DNMT1ADRB1POLBDNMT3BTYMS
SCHEMBL1332964 0.82 POLG (0.51) POLB

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-20210189392-A1 S-ANTIGEN TRANSPORT INHIBITING OLIGONUCLEOTIDE POLYMERS AND METHODS ALIGOS THERAPEUTICS, INC. 2021-06-24 — — US disclosed
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