SCHEMBL8246791

SCHEMBL8246791

COCCCn1c(NC(=O)c2cccc(N)c2)nc2cc(C(=O)N3CCC(CO)CC3)cnc21

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 20/20 0.66

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
SCHEMBL8246445 0.94 ADORA2A (0.64) ADORA2A
SCHEMBL8250481 0.94 ADORA2A (0.66) ADORA2A
SCHEMBL8250369 0.92 ADORA2A (0.68) ADORA2A
SCHEMBL8250308 0.92 ADORA2A (0.68) ADORA2A
SCHEMBL8240391 0.91 ADORA2A (0.65) ADORA2A
SCHEMBL8239742 0.91 ADORA2A (0.66) ADORA2A
SCHEMBL8246991 0.91 ADORA2A (0.72) ADORA2A
SCHEMBL8247595 0.91 ADORA2A (0.76) ADORA2A
SCHEMBL8240293 0.91 ADORA2A (0.79) ADORA2A
SCHEMBL8249508 0.90 ADORA2A (0.69) ADORA2A

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-2007022305-A2 2-AMINOIMIDAZOPYRIDINES FOR TREATING NEURODEGENERATIVE DISEASES PHARMACOPEIA, INC. (US) 2007-02-22 WO disclosed