SCHEMBL8804627

SCHEMBL8804627

CN(C(=O)Nc1ccccc1CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C1CCCN(Cc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.49
MAOA P21397 7/20 0.49
ACHE P22303 4/20 0.47
BCHE P06276 4/20 0.43
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 1/20 0.39

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
SCHEMBL8805910 0.90 MAOB (0.57) MAOBMAOAACHEBCHEMEN1
SCHEMBL8806070 0.85 ABCC1 (0.51) MAOBMAOAACHEKMT2APOLB
SCHEMBL8804158 0.84 MAOB (0.54) MAOBMAOAACHEBCHEMEN1
SCHEMBL8803795 0.84 MAOB (0.50) MAOBMAOAACHEBCHE
SCHEMBL8804205 0.83 MAOB (0.55) MAOBMAOAACHEBCHEKMT2A
SCHEMBL8804019 0.83 MAOB (0.43) MAOBMAOAACHEKMT2APOLB
SCHEMBL8806531 0.82 MAOB (0.57) MAOBMAOAACHEBCHE
SCHEMBL8804174 0.81 MAOB (0.54) MAOBMAOAACHEBCHEMEN1
SCHEMBL8804178 0.80 MAOB (0.54) MAOBMAOAACHEBCHE
SCHEMBL8803034 0.80 MAOB (0.61) MAOBMAOAACHEBCHEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625507-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-07-23 EP disclosed
US-5621010-A ANTIHYPERCHOLESTEROLEMIA AND ANTIATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-04-15 US disclosed
EP-0625507-A2 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-11-23 EP disclosed