SCHEMBL5726517

SCHEMBL5726517

O=C1C(=Cc2ccc(O)c(O)c2)CCc2cc(O)ccc21

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MIF P14174 15/20 0.79
CYP26A1 O43174 4/20 0.79
MAOB P27338 3/20 0.71
CYP19A1 P11511 1/20 0.67
CES2 O00748 1/20 0.65
MAOA P21397 2/20 0.61

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
SCHEMBL5725630 0.88 MIF (1.00) MIFCYP26A1MAOBCYP19A1MAOA
SCHEMBL28949926 0.87 CES2 (0.84) MIFMAOBCYP19A1CES2MAOA
SCHEMBL28949931 0.87 CES2 (0.84) MIFMAOBCYP19A1CES2MAOA
SCHEMBL30214428 0.87 CES2 (0.84) MIFMAOBCYP19A1CES2MAOA
SCHEMBL30214401 0.87 CES2 (0.84) MIFMAOBCYP19A1CES2MAOA
SCHEMBL7624219 0.87 MIF (0.70) MIFCYP26A1MAOBCES2MAOA
SCHEMBL5724989 0.84 MIF (1.00) MIFCYP26A1MAOBCYP19A1MAOA
SCHEMBL5726552 0.84 MIF (0.86) MIFCYP26A1MAOBCYP19A1MAOA
SCHEMBL551813 0.83 MIF (0.84) MIFCYP26A1MAOBCYP19A1MAOA
SCHEMBL5724962 0.83 MIF (0.84) MIFCYP26A1MAOBCYP19A1MAOA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10273467-A None JP disclosed
EP-0902003-B1 NOVEL TETRALONE OR BENZOPYRANONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME DAIICHI SEIYAKU CO (JP) 2006-07-26 EP disclosed
US-6080781-A Tetralone or benzopyranone derivatives and a method for producing them SNOW BRAND MILK PRODUCTS CO., LTD. (JP) 2000-06-27 US disclosed
EP-0902003-A1 NOVEL TETRALONE OR BENZOPYRANONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SNOW BRAND MILK PRODUCTS CO., LTD. (JP) 1999-03-17 EP disclosed
JP-H10273467-A NEW TETRALONE OR BENZOPYRANONE DERIVATIVE AND ITS PRODUCTION SNOW BRAND MILK PROD CO LTD 1998-10-13 JP disclosed