SCHEMBL7685437

SCHEMBL7685437

COCc1cncc(N2C[C@@H]3C[C@H]2CN3)c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 15/20 0.71
CHRNA4 P43681 15/20 0.71
CHRNB4 P30926 1/20 0.53
CHRNA3 P32297 1/20 0.53

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
SCHEMBL7690297 1.00 CHRNB2 (0.71) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5038434 0.83 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5375635 0.83 CHRNB2 (0.76) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5037209 0.83 CHRNB2 (0.76) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5375572 0.83 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL7679218 0.82 CHRNB2 (0.52) CHRNB2CHRNA4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL5034106 0.82 CHRNB2 (0.97) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5367436 0.81 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL7689605 0.81 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL13192500 0.80 CHRNB2 (0.56) 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