SCHEMBL4646583

SCHEMBL4646583

COc1cc(O)c(OC)c(O)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.75
CYP3A4 P08684 5/20 0.64
ALDH1A1 P00352 2/20 0.53
PTPN1 P18031 2/20 0.50
MAPT P10636 2/20 0.50
ABL1 P00519 2/20 0.48
ABCB1 P08183 2/20 0.48
BCR P11274 2/20 0.48
MAPK1 P28482 3/20 0.47
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ERN1 O75460 1/20 0.47
HPGD P15428 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 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
Iretol SCHEMBL3190103 0.86 TDP1 (1.00) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL14511772 0.85 TPMT (0.58) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL1402215 0.85 CYP3A4 (0.60) TDP1CYP3A4PTPN1MAPTMAPK1
SCHEMBL10106591 0.85 PTPN1 (0.62) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL29421877 0.85 PTPN1 (0.62) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL22003126 0.80 TDP1 (0.77) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL2224474 0.80 CYP1A1 (0.68) CYP3A4ALDH1A1MAPTABL1ABCB1
SCHEMBL2224480 0.80 CYP1A1 (0.68) CYP3A4ALDH1A1MAPTABL1ABCB1
SCHEMBL67338 0.80 CYP3A4 (0.67) TDP1CYP3A4ALDH1A1PTPN1MAPT
SCHEMBL11882610 0.79 TDP1 (0.60) TDP1CYP3A4ALDH1A1MAPTABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100560577-C The synthetic method of the synthetic method of wogonin and intermediate thereof and intermediate UNIV CHINA PHARMA (CN) 2009-11-18 CN claimed
CN-1915987-A Method for synthesizing Chinese baicalin, intermediate, and method for synthesizing intermediate UNIV CHINA PHARMACY (CN) 2007-02-21 CN claimed
JP-6025063-A None JP disclosed
JP-5271156-A None JP disclosed
CN-107298665-A Preparation method of flavonoid compound 上海医药工业研究院 2017-10-27 CN disclosed
CN-107298666-A Preparation method of flavonoid compound and intermediate thereof 上海医药工业研究院 2017-10-27 CN disclosed
CN-100560577-C The synthetic method of the synthetic method of wogonin and intermediate thereof and intermediate UNIV CHINA PHARMA (CN) 2009-11-18 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1915987-A Method for synthesizing Chinese baicalin, intermediate, and method for synthesizing intermediate UNIV CHINA PHARMACY (CN) 2007-02-21 CN disclosed
CN-1915987-A Method for synthesizing Chinese baicalin, intermediate, and method for synthesizing intermediate UNIV CHINA PHARMACY (CN) 2007-02-21 CN disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed
JP-H0625063-A PHENOXYBENZENE DERIVATIVE AND ITS PRODUCTION FUJI KAGAKU KOGYO KK 1994-02-01 JP disclosed
JP-H05271156-A DIPHENOXYBENZENE DERIVATIVE AND ITS PRODUCTION FUJI KAGAKU KOGYO KK 1993-10-19 JP disclosed
EP-0065720-B1 PROCESS FOR PREPARING HYDROXYPHENYL AMINE DERIVATIVES CASSELLA Aktiengesellschaft (DE) 1985-01-09 EP disclosed
EP-0065720-A1 Process for preparing hydroxyphenyl amine derivatives CASSELLA Aktiengesellschaft (DE) 1982-12-01 EP disclosed