SCHEMBL9239052

SCHEMBL9239052

O=[N+]([O-])c1cccc(OCC2CCCN2)c1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 2/20 0.62
CHRNA3 P32297 2/20 0.62
CHRNB2 P17787 1/20 0.55
CHRNA4 P43681 1/20 0.55
FAAH O00519 2/20 0.52
LTA4H P09960 2/20 0.50

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
SCHEMBL9239044 1.00 CHRNB4 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL9243580 1.00 CHRNB4 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
Hydrochloric Acid SCHEMBL9240142 0.99 CHRNB4 (0.61) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
Hydrochloric Acid SCHEMBL9240140 0.99 CHRNB4 (0.61) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
Hydrochloric Acid SCHEMBL9243429 0.99 CHRNB4 (0.61) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL9239686 0.91 CHRNA3 (0.59) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL9239680 0.91 CHRNA3 (0.59) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL27589827 0.88 CHRNB2 (0.51) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL9244564 0.83 CHRNB4 (0.54) CHRNB4CHRNA3CHRNB2CHRNA4FAAH
SCHEMBL9244561 0.83 CHRNB4 (0.54) CHRNB4CHRNA3CHRNB2CHRNA4FAAH

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
US-5472958-A 2-((nitro)phenoxymethyl) heterocyclic compounds that enhance cognitive function ABBOTT LABORATORIES (US) 1995-12-05 US claimed
US-5472958-A 2-((nitro)phenoxymethyl) heterocyclic compounds that enhance cognitive function ABBOTT LABORATORIES (US) 1995-12-05 US disclosed