SCHEMBL8245643

SCHEMBL8245643

CCN(C)C(=O)c1cnc2c(c1)nc(NC(=O)c1cccc(N)c1)n2CCCOC

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 19/20 0.80
ITK Q08881 1/20 0.44

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
SCHEMBL8242529 0.94 ADORA2A (0.70) ADORA2AITK
SCHEMBL8246370 0.93 ADORA2A (0.69) ADORA2AITK
SCHEMBL8246521 0.93 ADORA2A (0.79) ADORA2A
SCHEMBL8247597 0.93 ADORA2A (0.79) ADORA2A
SCHEMBL8249626 0.92 ADORA2A (0.68) ADORA2A
SCHEMBL8247815 0.91 ADORA2A (0.69) ADORA2A
SCHEMBL8247641 0.91 ADORA2A (0.66) ADORA2AITK
SCHEMBL8246921 0.91 ADORA2A (0.67) ADORA2A
SCHEMBL8239654 0.90 ADORA2A (0.74) ADORA2A
SCHEMBL8240655 0.90 ADORA2A (0.65) 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