SCHEMBL7409193

SCHEMBL7409193

Cc1ncccc1OC[C@@H]1CCN1C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.54
CHRNA4 P43681 3/20 0.54
CHRNB1 P11230 1/20 0.54
CHRNB4 P30926 1/20 0.54
CHRNA3 P32297 1/20 0.54
CHRNB3 Q05901 1/20 0.54
GPR119 Q8TDV5 10/20 0.48
SSTR4 P31391 2/20 0.47
GCK P35557 1/20 0.43
F2RL3 Q96RI0 1/20 0.42

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
SCHEMBL7453857 1.00 CHRNB2 (0.54) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL7415126 0.93 CHRNB2 (0.61) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL7415559 0.88 POLB (0.50) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL7484779 0.88 POLB (0.50) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL17878836 0.82 SSTR4 (0.49) GPR119SSTR4F2RL3
SCHEMBL21985454 0.82 ALOX5AP (0.40) GPR119F2RL3
SCHEMBL27462042 0.81 GPR119 (0.48) GPR119
SCHEMBL7412041 0.81 ALOX5AP (0.50) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL21845257 0.81 ALOX5AP (0.50) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL29960520 0.81 ALOX5AP (0.50) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3

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 5 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 disclosed
EP-1047690-A1 HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2000-11-02 EP disclosed
US-5948793-A 3-pyridyloxymethyl heterocyclic ether compounds useful in controlling neurotransmitter release ABBOTT LABORATORIES (US) 1999-09-07 US disclosed
WO-1999032480-A1 HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 1999-07-01 WO disclosed
US-5914328-A CONTROL DOPAMINE RELEASE, ACTIVATE CHOLINERGIC CHANNELS ABBOTT LABORATORIES (US) 1999-06-22 US disclosed