SCHEMBL7825115

SCHEMBL7825115

COc1cc(OC[C@@H]2CCN2)cnc1F

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.53
CHRNA4 P43681 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
SCHEMBL7831948 1.00 CHRNB2 (0.53) CHRNB2CHRNA4
SCHEMBL7818158 0.91 CHRNA3 (0.55) CHRNB2CHRNA4
SCHEMBL7829145 0.91 CHRNA3 (0.55) CHRNB2CHRNA4
SCHEMBL7832211 0.88
SCHEMBL7824493 0.88
SCHEMBL7818138 0.83 CHRNB2 (0.56) CHRNB2CHRNA4
SCHEMBL7816677 0.83 KDM4E (0.54) CHRNB2CHRNA4
SCHEMBL7825469 0.83 KDM4E (0.54) CHRNB2CHRNA4
SCHEMBL7824395 0.83 KDM4E (0.54) CHRNB2CHRNA4
SCHEMBL7477214 0.83 KDM4E (0.54) CHRNB2CHRNA4

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