SCHEMBL8818565

SCHEMBL8818565

CONc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)C(O)C1O

nearest known ligand 0.85

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 7/20 0.85
ADORA2A P29274 4/20 0.78
ADORA1 P30542 4/20 0.78
ADORA2B P29275 1/20 0.72
MEN1 O00255 1/20 0.72
CYP1A2 P05177 1/20 0.72
MAPK1 P28482 1/20 0.72
KMT2A Q03164 1/20 0.72
RXFP1 Q9HBX9 1/20 0.71
LMNA P02545 1/20 0.69
TP53 P04637 1/20 0.69

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
SCHEMBL8818548 1.00 ADORA3 (0.85) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8817947 0.92 ADORA3 (1.00) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8820459 0.92 ADORA3 (1.00) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8820007 0.91 ADORA3 (0.83) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8820000 0.91 ADORA3 (0.83) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8819207 0.90 ADORA3 (0.69) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8819192 0.90 ADORA3 (0.69) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8819453 0.89 ADORA3 (0.68) ADORA3ADORA2AADORA1ADORA2BMEN1
SCHEMBL8820620 0.88 ADORA3 (0.79) ADORA3ADORA2AADORA1
SCHEMBL8820609 0.88 ADORA3 (0.79) ADORA3ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5430027-A 2-chloro-N6 -substituted adenosines, their pharmaceutical compositions, and activity in treating ischemias NOVO NORDISK A/S (DK) 1995-07-04 US claimed
EP-0607367-A1 NOVEL ADENOSINE DERIVATIVES NOVO NORDISK A/S (DK) 1994-07-27 EP claimed
WO-1993023417-A1 NOVEL ADENOSINE DERIVATIVES NOVO NORDISK A/S (DK) 1993-11-25 WO claimed
WO-1997033590-A1 A METHOD OF TREATING DISORDERS RELATED TO CYTOKINES IN MAMMALS NOVO NORDISK A/S (DK) 1997-09-18 WO disclosed
WO-1997033591-A1 A METHOD OF TREATING DISORDERS RELATED TO CYTOKINES IN MAMMALS NOVO NORDISK A/S (DK) 1997-09-18 WO disclosed
US-5589467-A TREATING CENTRAL NERVOUS SYSTEM DISORDERS NOVO NORDISK A/S (DK) 1996-12-31 US disclosed
US-5430027-A 2-chloro-N6 -substituted adenosines, their pharmaceutical compositions, and activity in treating ischemias NOVO NORDISK A/S (DK) 1995-07-04 US disclosed
EP-0607367-A1 NOVEL ADENOSINE DERIVATIVES NOVO NORDISK A/S (DK) 1994-07-27 EP disclosed
WO-1993023417-A1 NOVEL ADENOSINE DERIVATIVES NOVO NORDISK A/S (DK) 1993-11-25 WO disclosed