SCHEMBL7305804

SCHEMBL7305804

Cc1c(C)c2ccc(OCc3cc(C(C)C)n(C)n3)cc2oc1=S

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.44
ACHE P22303 7/20 0.43
MAOA P21397 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
SCHEMBL7302386 0.88 MAOB (0.58) MAOBACHEMAOA
SCHEMBL7302076 0.82 MAOB (0.61) MAOBACHEMAOA
SCHEMBL7301258 0.80 MAOB (0.48) MAOBACHEMAOA
SCHEMBL7302695 0.77 MAOB (0.51) MAOBACHEMAOA
SCHEMBL7303152 0.77 ACHE (0.59) MAOBACHEMAOA
SCHEMBL7303229 0.76 TDP1 (0.60) MAOBACHE
SCHEMBL9135298 0.74 TBXAS1 (0.40) MAOBACHE
SCHEMBL7304194 0.73 MAOB (0.78) MAOBACHE
SCHEMBL7312144 0.71 MAOB (0.47) MAOBACHEMAOA
SCHEMBL7304086 0.71 SLC26A3 (0.43) MAOBACHE

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
US-5414006-A Monoamine oxidase inhibitors BASF AKTIENGESELLSCHAFT (DE) 1995-05-09 US disclosed
EP-0594036-A1 Arylalkyloxythiocoumarines, process for their preparation and therapeutical agents containing them BASF Aktiengesellschaft (DE) 1994-04-27 EP disclosed