SCHEMBL9811922

SCHEMBL9811922

C[C@H](Cc1ccc(OCC(N)=O)cc1)N(C[C@@H](O)COc1ccccc1)C[C@@H](O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.50
ALOX5 P09917 1/20 0.46
LTA4H P09960 2/20 0.42
ABCB1 P08183 2/20 0.42
LAP3 P28838 1/20 0.41

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
SCHEMBL9811915 1.00 MAOB (0.50) MAOBALOX5LTA4HABCB1LAP3
SCHEMBL9811926 1.00 MAOB (0.50) MAOBALOX5LTA4HABCB1LAP3
SCHEMBL9811980 0.94 ABCB1 (0.42) MAOBABCB1
SCHEMBL9811965 0.94 ABCB1 (0.42) MAOBABCB1
SCHEMBL9811991 0.94 ABCB1 (0.42) MAOBABCB1
SCHEMBL9811986 0.89 ABCB1 (0.50) MAOBABCB1
SCHEMBL9811979 0.89 ABCB1 (0.50) MAOBABCB1
SCHEMBL10528644 0.86 ADRB2 (0.51) MAOBALOX5
SCHEMBL10526893 0.86 ADRB2 (0.51) MAOBALOX5
SCHEMBL10528637 0.86 ADRB2 (0.51) MAOBALOX5

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-0170121-B1 2-HYDROXY-3-ARYLOXYPROPYL OR 2-HYDROXY-2-BENZOFURANYL ETHYL TERTIARY AMINE HAVING AN ANTI-HYPERGLYCAEMIC AND/OR ANTI-OBESITY ACTIVITY BEECHAM GROUP PLC (GB) 1991-06-19 EP disclosed
EP-0170121-A1 2-Hydroxy-3-aryloxypropyl or 2-hydroxy-2-benzofuranyl ethyl tertiary amine having an anti-hyperglycaemic and/or anti-obesity activity BEECHAM GROUP PLC (GB) 1986-02-05 EP disclosed