SCHEMBL3840208

SCHEMBL3840208

Clc1ccc(-c2ccc(OC3CN4CCC3CC4)nn2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.65
LSS P48449 1/20 0.49
GLA P06280 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
NTMT1 Q9BV86 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
TSHR P16473 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL3840206 1.00 CHRNA7 (0.65) CHRNA7LSSGLANPC1RAB9A
SCHEMBL3842285 0.89 CHRNA7 (0.64) CHRNA7LSSGLANPC1RAB9A
SCHEMBL3842282 0.89 CHRNA7 (0.64) CHRNA7LSSGLANPC1RAB9A
SCHEMBL3841313 0.88 CHRNA7 (0.69) CHRNA7LSSGLACHRM2CHRM1
SCHEMBL3841319 0.88 CHRNA7 (0.69) CHRNA7LSSGLACHRM2CHRM1
SCHEMBL5421431 0.87 CHRNA7 (0.65) CHRNA7CHRM2CHRM1CHRNB2CHRNB4
SCHEMBL1542514 0.87 CHRNA7 (0.65) CHRNA7NTMT1CHRM2CHRM1CHRNB2
SCHEMBL1459276 0.87 CHRNA7 (0.65) CHRNA7NTMT1CHRM2CHRM1CHRNB2
SCHEMBL1459274 0.87 CHRNA7 (0.65) CHRNA7NTMT1CHRM2CHRM1CHRNB2
SCHEMBL1542809 0.87 CHRNA7 (0.65) CHRNA7LSSNTMT1CHRM2CHRM1

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
US-8236803-B2 Aza-bicycloalkyl ethers and their use as alpha7-nAChR agonists NOVARTIS AG (CH) 2012-08-07 US claimed
EP-1537104-B1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS NOVARTIS AG (CH) 2009-11-11 EP claimed
EP-1537104-B1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS NOVARTIS AG (CH) 2009-11-11 EP disclosed