SCHEMBL5482184

SCHEMBL5482184

NNC(=O)c1ccccc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.61
CHRNA4 P43681 5/20 0.61
CHRNB4 P30926 4/20 0.61
CHRNA3 P32297 4/20 0.61
BCAT2 O15382 1/20 0.58
ALDH1A1 P00352 4/20 0.53
HTT P42858 4/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
POLB P06746 1/20 0.49

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
Biphenyl SCHEMBL27596494 0.98 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL1826396 0.96 CHRNB2 (0.65) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL30345390 0.96 CHRNB2 (0.65) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL541087 0.89 CHRNB2 (0.56) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL11325919 0.87 ALDH1A1 (0.50) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL3491462 0.86 CTSD (0.53) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
Biphenyl SCHEMBL27975765 0.84 MAPT (0.49) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL27907922 0.84 CHRNB2 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2
SCHEMBL4779761 0.84 CTSD (0.57) CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1
SCHEMBL7677836 0.84 HNF4A (0.68) CHRNB2CHRNA4CHRNB4CHRNA3BCAT2

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-20070123617-A1 Polyacetal resin composition DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT 2007-05-31 US disclosed