SCHEMBL7947708

SCHEMBL7947708

CN1CCCC1COc1ccccc1-c1nc(-c2ccccc2)no1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 4/20 0.54
CHRNA3 P32297 4/20 0.54
CHRNB1 P11230 2/20 0.51
CHRNB2 P17787 2/20 0.51
CHRNB3 Q05901 2/20 0.51
CHRNA4 P43681 1/20 0.51
TTR P02766 1/20 0.50
NPSR1 Q6W5P4 1/20 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
SCHEMBL7957021 0.77 KDM4E (0.58) TTRNPSR1
SCHEMBL7962009 0.76 KDM4E (0.60) TTRNPSR1
SCHEMBL5734066 0.75 MAPT (0.55) TTRNPSR1
SCHEMBL7947523 0.74 MAPT (0.54) TTRNPSR1
SCHEMBL7959021 0.73 MAPT (0.50) TTRNPSR1
SCHEMBL5733357 0.73 KDM4E (0.63) TTRNPSR1
SCHEMBL7957043 0.72 USP2 (0.64) TTRNPSR1
SCHEMBL26729833 0.71 CHRNB4 (0.65) CHRNB4CHRNA3CHRNB1CHRNB2CHRNB3
SCHEMBL7961699 0.71 SMN1; SMN2 (0.81) NPSR1
SCHEMBL12232966 0.70 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB1CHRNB2CHRNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277872-B1 ANTIISCHEMIC AGENTS; BRAIN DISORDERS BOEHRINGER INGELHEIM KG (DE) 2001-08-21 US disclosed