SCHEMBL7705879

SCHEMBL7705879

Cc1ccccc1-c1cc(N)n2nc(-c3ccco3)nc2c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.56

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
SCHEMBL7487756 0.86 ADORA2A (0.56) ADORA2A
SCHEMBL7705841 0.86 ADORA2A (0.56) ADORA2A
SCHEMBL7708829 0.85 ADORA2A (0.70) ADORA2A
SCHEMBL7711605 0.85 ADORA2A (0.55) ADORA2A
SCHEMBL7711726 0.84 ADORA2A (0.54) ADORA2A
SCHEMBL7708427 0.82 ADORA2A (0.53) ADORA2A
SCHEMBL7487423 0.81 ADORA2A (0.56) ADORA2A
SCHEMBL7486668 0.81 ADORA2A (0.52) ADORA2A
SCHEMBL7486781 0.80 ADORA2A (0.56) ADORA2A
SCHEMBL7430360 0.80 ADORA2A (0.56) 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
US-6355653-B1 DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS HOFFMANN-LA ROCHE INC. 2002-03-12 US disclosed