SCHEMBL3840601

SCHEMBL3840601

Cc1ccc(Cl)c(-c2ccc(O[C@H]3CN4CCC3CC4)cn2)c1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.69
LSS P48449 1/20 0.43
KDM1A O60341 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CHRM1 P11229 1/20 0.37

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
SCHEMBL3840606 1.00 CHRNA7 (0.69) CHRNA7LSSKDM1ACYP1A2CYP2D6
SCHEMBL3839404 0.91 CHRNA7 (0.69) CHRNA7LSSCYP1A2CYP2D6CHRM1
SCHEMBL3839400 0.91 CHRNA7 (0.69) CHRNA7LSSCYP1A2CYP2D6CHRM1
SCHEMBL3840559 0.84 CHRNA7 (0.61) CHRNA7LSSCHRM1
SCHEMBL3840558 0.84 CHRNA7 (0.61) CHRNA7LSSCHRM1
Aqw051 SCHEMBL1459287 0.82 CHRNA7 (1.00) CHRNA7LSSCYP1A2CYP2D6CHRM1
Aqw051 SCHEMBL1459285 0.82 CHRNA7 (1.00) CHRNA7LSSCYP1A2CYP2D6CHRM1
Aqw051 SCHEMBL29463332 0.82 CHRNA7 (1.00) CHRNA7LSSCYP1A2CYP2D6CHRM1
Aqw051 SCHEMBL29604108 0.82 CHRNA7 (1.00) CHRNA7LSSCYP1A2CYP2D6CHRM1
SCHEMBL3840605 0.80 CHRNA7 (0.50) CHRNA7LSSCYP1A2CYP2D6CHRM1

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