SCHEMBL6190367

SCHEMBL6190367

S=CCOc1ccc(N2CC3CNCC3C2)cn1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 9/20 0.50
CHRNA4 P43681 9/20 0.50
CHRNA7 P36544 2/20 0.50
BPTF Q12830 1/20 0.42
CHRNB4 P30926 6/20 0.41
CHRNA3 P32297 6/20 0.41

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
SCHEMBL6188672 0.80 CHRNB2 (0.51) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL1527035 0.79 CHRNB2 (0.50) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL1527033 0.79 CHRNB2 (0.50) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL6187336 0.78 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL6350419 0.75 CHRNB2 (0.66) CHRNB2CHRNA4
SCHEMBL650890 0.71 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL650891 0.71 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL650815 0.71 CHRNB2 (0.60) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL6191046 0.71 CHRNB2 (0.60) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL6190806 0.71 CHRNB2 (0.60) CHRNB2CHRNA4CHRNA7BPTFCHRNB4

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-1274710-B1 NOVEL HETEROARYL-DIAZABICYCLOALKANES NEUROSEARCH AS (DK) 2005-02-23 EP claimed
EP-1554274-A1 1-ACYL-PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS GLAXO GROUP LIMITED (GB) 2005-07-20 EP disclosed
WO-2004037818-A1 1-ACYL-PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS GLAXO GROUP LIMITED (GB) 2004-05-06 WO disclosed