SCHEMBL3842977

SCHEMBL3842977

Cc1cccc(-c2ccc(OC3CN4CCC3CC4)cn2)c1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.75
ALDH1A1 P00352 1/20 0.45
KDM1A O60341 1/20 0.44
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
HTR3A P46098 1/20 0.40
LSS P48449 1/20 0.40

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
SCHEMBL3840510 1.00 CHRNA7 (0.75) CHRNA7ALDH1A1KDM1ACHRNB2CHRNA4
Aqw051 SCHEMBL1459285 0.86 CHRNA7 (1.00) CHRNA7LSS
Aqw051 SCHEMBL1459287 0.86 CHRNA7 (1.00) CHRNA7LSS
Aqw051 SCHEMBL29604108 0.86 CHRNA7 (1.00) CHRNA7LSS
Aqw051 SCHEMBL29463332 0.86 CHRNA7 (1.00) CHRNA7LSS
SCHEMBL1458612 0.86 CHRNA7 (0.77) CHRNA7LSS
SCHEMBL1458614 0.86 CHRNA7 (0.77) CHRNA7LSS
SCHEMBL1459239 0.85 CHRNA7 (0.77) CHRNA7LSS
SCHEMBL1459240 0.85 CHRNA7 (0.77) CHRNA7LSS
SCHEMBL3841703 0.84 CHRNA7 (0.61) CHRNA7KDM1A

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 2 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-7579362-B2 Aza-bicycloalkyl ethers and their use as alpha7-nAChR agonists NOVARTIS AG (CH) 2009-08-25 US claimed