SCHEMBL21227129

SCHEMBL21227129

CCc1cn([C@H]2C[C@H](OC)[C@@H](COC)O2)c(=O)nc1N

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 8/20 0.40
▸ DNMT3B Q9UBC3 3/20 0.39
▸ ADRB1 P08588 1/20 0.35
▸ FPR2 P25090 2/20 0.35
▸ ALB P02768 1/20 0.34
▸ POLG P54098 1/20 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
SCHEMBL68514 0.88 DNMT1 (0.36) DNMT1ADRB1ALBPOLG
SCHEMBL18573362 0.88 DNMT1 (0.36) DNMT1ADRB1ALBPOLG
SCHEMBL12590058 0.88 DNMT1 (0.36) DNMT1ADRB1ALBPOLG
SCHEMBL14555941 0.87 DNMT1 (0.38) DNMT1DNMT3BADRB1ALBPOLG
SCHEMBL26870123 0.83 ALB (0.34) DNMT1DNMT3BADRB1ALBPOLG
SCHEMBL26757667 0.82 DNMT1 (0.43) DNMT1DNMT3B
SCHEMBL26757263 0.80 DNMT1 (0.43) DNMT1DNMT3BADRB1FPR2POLG
SCHEMBL26757271 0.80 DNMT1 (0.43) DNMT1DNMT3BADRB1FPR2POLG
SCHEMBL23200453 0.80 POLB (0.51) ALBPOLG
SCHEMBL12015121 0.80 ALB (0.38) DNMT1DNMT3BADRB1ALBPOLG

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
EP-3049523-B1 MULTIAPTAMER TARGET DETECTION SOMALOGIC INC (US) 2019-08-07 — — EP disclosed
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