SCHEMBL7303013

SCHEMBL7303013

Cc1c(C)c2ccc(OCc3nc(C(C)C)no3)cc2oc1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.58
ACHE P22303 9/20 0.56
MAOA P21397 2/20 0.54

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
SCHEMBL7302703 0.86 ACHE (0.60) MAOBACHEMAOA
SCHEMBL7301127 0.81 ACHE (0.54) MAOBACHEMAOA
SCHEMBL7301316 0.79 MAOB (0.59) MAOBACHEMAOA
SCHEMBL7294468 0.76 ACHE (0.63) MAOBACHEMAOA
SCHEMBL7300837 0.76 ACHE (0.63) MAOBACHEMAOA
SCHEMBL7301295 0.75 ACHE (0.62) MAOBACHEMAOA
SCHEMBL5618032 0.75 MAOB (0.77) MAOBACHEMAOA
SCHEMBL5617690 0.75 MAOB (0.66) MAOBACHEMAOA
SCHEMBL7296704 0.75 MAOB (0.55) MAOBACHEMAOA
SCHEMBL5617782 0.75 ALDH1A1 (0.58) MAOBACHEMAOA

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-0363796-B1 HETEROCYCLICALLY SUBSTITUTED ALKOXYCOUMARINES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL AGENTS CONTAINING SAME BASF Aktiengesellschaft (DE) 1993-08-11 EP disclosed
US-5227392-A Monoamine oxidase inhibitors BASF AKTIENGESELLSCHAFT (DE) 1993-07-13 US disclosed
EP-0363796-A1 Heterocyclically substituted alkoxycoumarines, method for their preparation and therapeutical agents containing same BASF Aktiengesellschaft (DE) 1990-04-18 EP disclosed