SCHEMBL11198077

SCHEMBL11198077

COC(=O)[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1N(C(=O)OC(C)(C)C)C(=O)C(N)Cc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 4/20 0.54
▸ TRDMT1 O14717 1/20 0.49
▸ EZH2 Q15910 3/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ ADORA2B P29275 1/20 0.47
▸ WDR5 P61964 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ RBBP5 Q15291 1/20 0.46
▸ DPY30 Q9C005 1/20 0.46
▸ ASH2L Q9UBL3 1/20 0.46
▸ HSP90B1 P14625 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ DOT1L Q8TEK3 1/20 0.46

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
SCHEMBL10888445 1.00 AHCY (0.54) AHCYTRDMT1EZH2ADORA3ADORA2B
SCHEMBL10886614 0.92 AHCY (0.51) AHCYADORA3ADORA2BWDR5KMT2A
SCHEMBL10888564 0.90 AHCY (0.53) AHCYADORA3ADORA2BWDR5KMT2A
SCHEMBL11060597 0.88 TRDMT1 (0.54) AHCYTRDMT1ADORA2BHSP90B1ATM
SCHEMBL10882618 0.87 AHCY (0.49) AHCYTRDMT1EZH2ADORA3HSP90B1
SCHEMBL10886531 0.86 HSP90B1 (0.54) AHCYADORA3ADORA2BKMT2AHSP90B1
SCHEMBL10885304 0.84 HSP90B1 (0.54) AHCYTRDMT1HSP90B1
SCHEMBL11060572 0.84 ATM (0.46) AHCYTRDMT1WDR5KMT2ARBBP5
SCHEMBL10884362 0.83 HSP90B1 (0.56) AHCYADORA3ADORA2BWDR5KMT2A
SCHEMBL10883715 0.83 TRDMT1 (0.49) AHCYTRDMT1ADORA3ATMDOT1L

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-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
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