SCHEMBL7464016

SCHEMBL7464016

c1ccc(-c2ccc(O[C@H]3CCNC3)nc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PAICS P22234 1/20 0.48
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
TDO2 P48775 1/20 0.46
MKNK1 Q9BUB5 2/20 0.45
MKNK2 Q9HBH9 1/20 0.45
HRH1 P35367 1/20 0.43
HPGDS O60760 1/20 0.43
PRKCZ Q05513 1/20 0.43
SYK P43405 1/20 0.43
FAAH O00519 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
SCHEMBL6886586 0.79 FAAH (0.46) TDO2MKNK1MKNK2FAAH
SCHEMBL6786345 0.78 TDO2 (0.66) PAICSTDO2MKNK1MKNK2HRH1
SCHEMBL18077122 0.78 TDO2 (0.52) CHRNB2CHRNA4TDO2PRKCZ
SCHEMBL26774162 0.78 CHRNB2 (0.47) CHRNB2CHRNA4TDO2MKNK1PRKCZ
SCHEMBL26774172 0.78 CHRNB2 (0.47) CHRNB2CHRNA4TDO2MKNK1PRKCZ
SCHEMBL4828298 0.78 CHRNB2 (0.47) CHRNB2CHRNA4TDO2MKNK1PRKCZ
SCHEMBL4823398 0.78 HTR2C (0.48) CHRNB2CHRNA4
SCHEMBL13560051 0.78 HTR2C (0.48) CHRNB2CHRNA4
SCHEMBL28671432 0.78 TDO2 (0.52) CHRNB2CHRNA4TDO2PRKCZ
SCHEMBL26774177 0.78 CHRNB2 (0.47) CHRNB2CHRNA4TDO2MKNK1PRKCZ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212319-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2002-06-12 EP claimed
WO-2001019817-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 2001-03-22 WO claimed