SCHEMBL29540124

SCHEMBL29540124

Nc1ncnc2c1ncn2C1OCC(OC(=O)C(N)CCCCNC(=O)OCc2ccccc2)C1O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 6/20 0.61
▸ AHCY P23526 3/20 0.52
▸ PRKACA P17612 3/20 0.48
▸ NNMT P40261 1/20 0.48
▸ WDR5 P61964 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ RBBP5 Q15291 3/20 0.45
▸ DPY30 Q9C005 3/20 0.45
▸ ASH2L Q9UBL3 3/20 0.45
▸ CARM1 Q86X55 1/20 0.45
▸ DPP8 Q6V1X1 1/20 0.44
▸ DPP7 Q9UHL4 1/20 0.44
▸ PRMT1 Q99873 1/20 0.44

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
SCHEMBL30744243 0.90 DOT1L (0.49) DOT1LAHCYPRKACANNMTPRMT1
SCHEMBL16578293 0.82 DOT1L (0.68) DOT1LAHCYPRKACANNMTWDR5
SCHEMBL10887920 0.75 DOT1L (0.62) DOT1LAHCYPRKACA
SCHEMBL30744295 0.74 KLK7 (0.46) DOT1LAHCYPRKACA
SCHEMBL5944004 0.74 DOT1L (0.61) DOT1LAHCYPRKACA
SCHEMBL23056483 0.74 DOT1L (0.51) DOT1LPRKACA
SCHEMBL16574770 0.73 DOT1L (0.60) DOT1LAHCYPRKACA
SCHEMBL22799204 0.72 AHCY (0.55) AHCY
SCHEMBL30744302 0.72 AHCY (0.45) DOT1LAHCYPRKACA
SCHEMBL30744251 0.72 ADORA3 (0.53) DOT1LAHCYKMT2A

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-3974563-A1 CYCLIC PEPTIDES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-03-30 — — EP disclosed
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