SCHEMBL7688755

SCHEMBL7688755

Ic1cncc(N2CC3CNC(C3)C2)c1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.62
CHRNA4 P43681 3/20 0.62
CHRNB4 P30926 9/20 0.49
CHRNA3 P32297 9/20 0.49
CHRNA7 P36544 1/20 0.43

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
SCHEMBL7687904 0.87 CHRNB2 (0.47) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL7681509 0.84 CHRNB2 (0.63) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL6186895 0.84 CHRNB4 (0.57) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL7684252 0.83 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL7681539 0.83 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL7683728 0.83 CHRNB4 (0.68) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL7687924 0.80 CHRNB2 (0.70) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL7685734 0.80 CHRNB2 (0.63) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL4003627 0.80 CHRNB4 (0.73) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL5371167 0.80 CHRNB2 (0.63) CHRNB2CHRNA4CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6440970-B1 ACTIVATING NICOTINIC CHOLERGINIC RECEPTORS TARGACEPT, INC. 2002-08-27 US disclosed