SCHEMBL7302076

SCHEMBL7302076

Cc1c(Cl)c(=O)oc2cc(OCc3cc(C(C)C)n(C)n3)ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.61
MAOA P21397 4/20 0.61
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 4/20 0.57
GAA P10253 4/20 0.57
HPGD P15428 4/20 0.57
LMNA P02545 1/20 0.55
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
HSD17B10 Q99714 2/20 0.52
ACHE P22303 3/20 0.49
ALPL P05186 2/20 0.49
ALPI P09923 2/20 0.49
USP2 O75604 1/20 0.48
GLA P06280 1/20 0.48

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 0.92 MAOB (0.58) MAOBMAOAACHE
SCHEMBL7301258 0.85 MAOB (0.48) MAOBMAOAKDM4EALDH1A1HPGD
SCHEMBL7305804 0.82 MAOB (0.44) MAOBMAOAACHE
SCHEMBL7295957 0.82 MAOB (0.40) MAOBMAOAKDM4EALDH1A1GAA
SCHEMBL7303229 0.81 TDP1 (0.60) MAOBKDM4EALDH1A1GAAHPGD
SCHEMBL7303152 0.81 ACHE (0.59) MAOBMAOAKDM4EALDH1A1HPGD
SCHEMBL5618481 0.78 MAOB (0.77) MAOBMAOAKDM4EALDH1A1GAA
SCHEMBL7304086 0.77 SLC26A3 (0.43) MAOBKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9135298 0.74 TBXAS1 (0.40) MAOBACHE
SCHEMBL15842938 0.74 KDM4E (1.00) MAOBMAOAKDM4EALDH1A1GAA

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 4 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
US-5073563-A Enzyme inhibitors, CNS BASF AKTIENGESELLSCHAFT (DE) 1991-12-17 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