SCHEMBL7372710

SCHEMBL7372710

CN1CCC[C@@H]1COc1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 7/20 1.00
CHRNB1 P11230 6/20 1.00
CHRNB4 P30926 6/20 1.00
CHRNA3 P32297 6/20 1.00
CHRNB3 Q05901 6/20 1.00
CHRNA4 P43681 5/20 1.00
CHRNA1 P02708 1/20 1.00
CHRNA7 P36544 1/20 1.00

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
SCHEMBL29484629 1.00 CHRNB2 (1.00) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL12214039 1.00 CHRNB2 (1.00) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL676032 1.00 CHRNB2 (1.00) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
Hydrochloric Acid SCHEMBL7839221 0.99 CHRNB2 (0.97) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL8435491 0.96 CHRNB2 (0.92) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL8438369 0.96 CHRNB2 (0.92) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
Hydrochloric Acid SCHEMBL7406679 0.94 CHRNB2 (0.90) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL13424978 0.93 CHRNA3 (0.86) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL905202 0.93 CHRNA3 (0.86) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL30820824 0.93 CHRNA3 (0.86) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663912-B1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2001-12-12 EP claimed
US-5948793-A 3-pyridyloxymethyl heterocyclic ether compounds useful in controlling neurotransmitter release ABBOTT LABORATORIES (US) 1999-09-07 US claimed
EP-0663912-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1995-07-26 EP claimed
EP-0663912-A4 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION. ABBOTT LAB (US) 1995-02-17 EP claimed
WO-1994008992-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1994-04-28 WO claimed
EP-0663912-B1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2001-12-12 EP disclosed
US-5948793-A 3-pyridyloxymethyl heterocyclic ether compounds useful in controlling neurotransmitter release ABBOTT LABORATORIES (US) 1999-09-07 US disclosed
EP-0663912-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1995-07-26 EP disclosed
EP-0663912-A4 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION. ABBOTT LAB (US) 1995-02-17 EP disclosed
WO-1994008992-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1994-04-28 WO disclosed