SCHEMBL28076895

SCHEMBL28076895

Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1C(=O)NCc1ccc2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 7/20 0.49
▸ ADRB1 P08588 1/20 0.46
▸ DNMT3B Q9UBC3 2/20 0.46
▸ FPR2 P25090 1/20 0.42
▸ GALR3 O60755 1/20 0.39
▸ NR2F2 P24468 1/20 0.39

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
SCHEMBL27093360 0.90 DNMT1 (0.53) DNMT1ADRB1DNMT3BFPR2GALR3
SCHEMBL27093273 0.88 DNMT1 (0.50) DNMT1ADRB1DNMT3BFPR2GALR3
SCHEMBL29125140 0.88 DNMT1 (0.50) DNMT1ADRB1DNMT3BFPR2GALR3
SCHEMBL28076892 0.86 DNMT1 (0.51) DNMT1ADRB1DNMT3BFPR2
SCHEMBL28803593 0.84 TK1 (0.52) —
SCHEMBL28076667 0.83 DNMT1 (0.53) DNMT1ADRB1DNMT3BFPR2
SCHEMBL17943262 0.82 SLC28A2 (0.44) DNMT1GALR3NR2F2
SCHEMBL28076665 0.82 DNMT1 (0.52) DNMT1ADRB1DNMT3BFPR2
Doxecitine SCHEMBL17027816 0.81 DNMT1 (0.46) DNMT1ADRB1DNMT3B
SCHEMBL27093275 0.80 SLC28A2 (0.45) —

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
CN-105658658-A Cytidine-5-carboxamide modified nucleotide compositions and methods related thereto 私募蛋白质体公司 2016-06-08 — — CN disclosed
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