SCHEMBL9628529

SCHEMBL9628529

CCCNC(C)CCc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.56
MAOB P27338 5/20 0.55
SLC2A1 P11166 1/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SIGMAR1 Q99720 1/20 0.48
MAOA P21397 1/20 0.48
ALOX5 P09917 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9627209 0.91 BCHE (0.58) BCHEMAOBSLC2A1MAOAALOX5
SCHEMBL9626554 0.90 SLC2A1 (0.59) BCHEMAOBSLC2A1MEN1KMT2A
SCHEMBL9626522 0.85 MAOB (0.60) BCHEMAOBSLC2A1MAOAALOX5
SCHEMBL9627382 0.80 MAOB (0.63) MAOBMAOAALOX5
SCHEMBL9626343 0.80 MAOB (0.67) MAOBMAOAALOX5
SCHEMBL9628125 0.80 SLC2A1 (0.50) BCHEMAOBSLC2A1MEN1KMT2A
SCHEMBL9626408 0.79 MAOB (0.57) BCHEMAOBSLC2A1SIGMAR1MAOA
SCHEMBL9628030 0.78 MAOB (0.60) BCHEMAOBMAOAALOX5
SCHEMBL9628272 0.78 MAOB (0.60) BCHEMAOBMAOAALOX5
Hydrochloric Acid SCHEMBL11211625 0.76 SLC2A1 (0.62) MAOBSLC2A1MEN1KMT2ASIGMAR1

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-0477184-A1 INHIBITORS OF MONO-AMINE OXIDASE, PROCESS FOR THEIR PREPARATION, AND THEIR USE IN THERAPEUTICS. FOURNIER INDUSTRIE ET SANTE (FR) 1992-04-01 EP disclosed
WO-1990011997-A2 INHIBITORS OF MONO-AMINE OXIDASE, PROCESS FOR THEIR PREPARATION, AND THEIR USE IN THERAPEUTICS. FOURNIER INNOVATION ET SYNERGIE (FR) 1990-10-18 WO disclosed