SCHEMBL20784337

SCHEMBL20784337

CC(NC(=O)c1nc(Cl)nc2ccsc12)c1cccnc1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 18/20 0.76
ADORA2A P29274 15/20 0.76
ADORA3 P0DMS8 2/20 0.57
ADORA1 P30542 1/20 0.57

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
SCHEMBL20785255 0.87 ADORA2B (0.73) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20784339 0.86 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20785019 0.86 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL24261250 0.86 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20785020 0.86 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL24261255 0.86 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL24261176 0.82 ADORA2B (0.82) ADORA2BADORA2AADORA3ADORA1
SCHEMBL24261601 0.77 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20784321 0.77 ADORA2B (1.00) ADORA2BADORA2AADORA3ADORA1
SCHEMBL24261174 0.76 ADORA2A (0.66) ADORA2BADORA2AADORA3ADORA1

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
WO-2019046784-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR CORVUS PHARMACEUTICALS, INC. (US) 2019-03-07 WO disclosed