SCHEMBL3844537

SCHEMBL3844537

N#Cc1cccc(-c2cnc(OC3CN4CCC3CC4)nc2)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.45
HRH3 Q9Y5N1 1/20 0.43
CHRNA7 P36544 1/20 0.43
TLR7 Q9NYK1 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CLK4 Q9HAZ1 1/20 0.39

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
SCHEMBL3844172 0.83 CHRNA7 (0.48) CHRNA7TLR7
SCHEMBL3844170 0.83 CHRNA7 (0.48) CHRNA7TLR7
SCHEMBL5417741 0.82 MAP4K4 (0.47) CHRNA7
SCHEMBL3840502 0.82 TSHR (0.49) CHRNA7
SCHEMBL3840338 0.82 TSHR (0.49) CHRNA7
SCHEMBL3843580 0.82 CHRNA7 (0.51) CHRNA7
SCHEMBL5397013 0.82 MAP4K4 (0.47) CHRNA7
SCHEMBL3843584 0.82 CHRNA7 (0.51) CHRNA7
SCHEMBL5394680 0.82 MAP4K4 (0.47) CHRNA7
SCHEMBL999496 0.81 CHRNA7 (0.48) CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012451-B2 Aza-bicycloalkyl ethers and their use as ALPHA7-nachr agonists NOVARTIS AG (CH) 2015-04-21 US claimed
EP-1537104-B1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS NOVARTIS AG (CH) 2009-11-11 EP claimed
US-9012451-B2 Aza-bicycloalkyl ethers and their use as ALPHA7-nachr agonists NOVARTIS AG (CH) 2015-04-21 US disclosed
US-9012451-B2 Aza-bicycloalkyl ethers and their use as ALPHA7-nachr agonists NOVARTIS AG (CH) 2015-04-21 US disclosed