SCHEMBL7469464

SCHEMBL7469464

CCOC(=O)c1cc2cccc(C)c2o1.[NaH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.52
MAOA P21397 1/20 0.52
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
KDM4E B2RXH2 4/20 0.46
MAPT P10636 4/20 0.46
ALDH1A1 P00352 2/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
HSD17B10 Q99714 2/20 0.45
CYP1A2 P05177 1/20 0.45
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL5311626 0.98 MAOA (0.53) MAOBMAOACA12CA1CA2
SCHEMBL4675984 0.87 MAOA (0.68) MAOBMAOACA12CA1CA2
SCHEMBL2303899 0.84 MAOA (0.51) MAOBMAOACA12CA1CA2
SCHEMBL14897812 0.84 MAOB (0.51) MAOBMAOACA12CA1CA2
SCHEMBL17842824 0.84 MAOB (0.51) MAOBMAOACA12CA1CA2
SCHEMBL931020 0.84 MAOB (0.51) MAOBMAOACA12CA1CA2
SCHEMBL3076627 0.83 LMNA (0.51) MAOBMAOAMAPTALDH1A1RAB9A
SCHEMBL73410 0.83 LMNA (0.68) MAOBMAOACA12CA1CA2
SCHEMBL5309471 0.82 KDM4E (0.51) MAOBMAOACA12CA1CA2
SCHEMBL9529549 0.81 KDM4E (0.54) MAOBMAOAKDM4EMAPTALDH1A1

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-1177176-A1 TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS Aventis Pharma Deutschland GmbH (DE) 2002-02-06 EP disclosed
WO-2000064876-A1 TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-11-02 WO disclosed