SCHEMBL3842985

SCHEMBL3842985

Fc1cccc(-c2cnc(O[C@H]3CN4CCC3CC4)nc2)c1F

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.42
CNR2 P34972 1/20 0.42
CHRM2 P08172 4/20 0.40
CHRM1 P11229 4/20 0.40
CHRM3 P20309 4/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
TLR7 Q9NYK1 1/20 0.38

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
SCHEMBL3842988 1.00 CHRNA7 (0.42) CHRNA7CNR2CHRM2CHRM1CHRM3
SCHEMBL16642068 0.92 CNR2 (0.40) CHRNA7CNR2CHRM2CHRM1CHRM3
SCHEMBL3839851 0.90 CHRM2 (0.44) CHRNA7CHRM2CHRM1CHRM3CHRM4
SCHEMBL3839849 0.90 CHRM2 (0.44) CHRNA7CHRM2CHRM1CHRM3CHRM4
SCHEMBL16642066 0.86 CHRM2 (0.43) CHRNA7CHRM2CHRM1CHRM3CHRM4
SCHEMBL3839987 0.83 CHRM3 (0.47) CHRNA7CHRM2CHRM1CHRM3TLR7
SCHEMBL3839991 0.83 CHRM3 (0.47) CHRNA7CHRM2CHRM1CHRM3TLR7
SCHEMBL3840839 0.81 CHRM2 (0.46) CHRNA7CHRM2CHRM1CHRM3CHRM4
SCHEMBL3840281 0.81 CHRM2 (0.46) CHRNA7CHRM2CHRM1CHRM3CHRM4
SCHEMBL3840344 0.81 CNR2 (0.46) CHRNA7CNR2CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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