SCHEMBL2118571

SCHEMBL2118571

CSC[C@H]1O[C@@H](n2cnc3c(N)nc(C)nc32)C(O)C1O

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 7/20 0.78
DNMT1 P26358 1/20 0.68
DNMT3B Q9UBC3 1/20 0.68
ADORA2A P29274 4/20 0.66
AHCY P23526 2/20 0.61
NADK O95544 1/20 0.59
LMNA P02545 1/20 0.58
NT5E P21589 1/20 0.58
HIF1A Q16665 1/20 0.58
ADORA2B P29275 2/20 0.58
RNASEL Q05823 1/20 0.58

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
SCHEMBL2118563 1.00 ADORA3 (0.78) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL15926825 1.00 ADORA3 (0.78) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL19849513 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL5354361 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL5354351 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL13860338 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL5354088 0.88 ADORA3 (1.00) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL13860337 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL5354093 0.88 ADORA3 (1.00) ADORA3DNMT1DNMT3BADORA2AAHCY
SCHEMBL5362972 0.88 ADORA3 (0.77) ADORA3DNMT1DNMT3BADORA2AAHCY

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150119351-A1 THERAPY OF TUMORS AND INFECTIOUS AGENTS DEFICIENT IN METHYLTHIOADENOSINE PHOSPHORYLASE LUBIN ADAM (US) 2015-04-30 US claimed
US-8796241-B2 Therapy of tumors and infectious agents deficient in methylthioadenosine phosphorylase LUBIN ADAM (US) 2014-08-05 US claimed
US-20120094947-A1 METHOD FOR THE SELECTIVE THERAPY OF DISEASE LUBIN ADAM (US) 2012-04-19 US claimed
EP-2192905-A2 METHOD FOR THE SELECTIVE THERAPY OF DISEASE Lubin, Adam (US) 2010-06-09 EP claimed
WO-2009032057-A2 METHOD FOR THE SELECTIVE THERAPY OF DISEASE LUBIN ADAM (US) 2009-03-12 WO claimed
US-20150119351-A1 THERAPY OF TUMORS AND INFECTIOUS AGENTS DEFICIENT IN METHYLTHIOADENOSINE PHOSPHORYLASE LUBIN ADAM (US) 2015-04-30 US disclosed
US-8796241-B2 Therapy of tumors and infectious agents deficient in methylthioadenosine phosphorylase LUBIN ADAM (US) 2014-08-05 US disclosed
US-20120094947-A1 METHOD FOR THE SELECTIVE THERAPY OF DISEASE LUBIN ADAM (US) 2012-04-19 US disclosed
EP-2192905-A2 METHOD FOR THE SELECTIVE THERAPY OF DISEASE Lubin, Adam (US) 2010-06-09 EP disclosed
WO-2009032057-A2 METHOD FOR THE SELECTIVE THERAPY OF DISEASE LUBIN ADAM (US) 2009-03-12 WO disclosed