SCHEMBL7828293

SCHEMBL7828293

CCOc1cc(OC[C@@H]2CCCN2)cnc1F

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNA3 P32297 3/20 0.54
CHRNB4 P30926 1/20 0.54
CHRNB2 P17787 3/20 0.54
CHRNA4 P43681 3/20 0.54

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
SCHEMBL7816552 1.00 CHRNA3 (0.54) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7824493 0.92
SCHEMBL7832211 0.92
SCHEMBL7818158 0.90 CHRNA3 (0.55) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7829145 0.90 CHRNA3 (0.55) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7826097 0.85 CHRNA3 (0.57) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7460096 0.85 CHRNA3 (0.57) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7825114 0.84 CHRNA3 (0.56) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL7825928 0.84 CHRNA3 (0.56) CHRNA3CHRNB4CHRNB2CHRNA4
SCHEMBL8592792 0.82 CHRNA3 (0.56) CHRNA3CHRNB4CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846114-B1 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LAB (US) 2001-12-05 EP claimed
EP-0846114-B1 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LAB (US) 2001-12-05 EP disclosed
EP-0846114-A1 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 1998-06-10 EP disclosed
WO-1996040682-A1 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 1996-12-19 WO disclosed