SCHEMBL11325919

SCHEMBL11325919

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
CHRNB2 P17787 3/20 0.50
CHRNB4 P30926 3/20 0.50
CHRNA3 P32297 3/20 0.50
CHRNA4 P43681 3/20 0.50
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
BCAT2 O15382 1/20 0.47
CTSD P07339 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
GAA P10253 3/20 0.45
HTT P42858 2/20 0.44
GFER P55789 1/20 0.44
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5482184 0.87 CHRNB2 (0.61) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1826396 0.87 CHRNB2 (0.65) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL30345390 0.87 CHRNB2 (0.65) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
Biphenyl SCHEMBL27596494 0.85 CHRNB2 (0.62) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3491462 0.84 CTSD (0.53) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27907922 0.83 CHRNB2 (0.51) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4779761 0.82 CTSD (0.57) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL28583907 0.81 CHRNB2 (0.50) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL31087643 0.81 ALDH1A1 (0.62) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL28086048 0.81 ALDH1A1 (0.62) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4

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-4245037-A FOGGING AGENT FUJI PHOTO FILM CO., LTD. (JP) 1981-01-13 US disclosed