SCHEMBL4335276

SCHEMBL4335276

CC(C)COc1ccccc1C(=O)OC(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TSHR P16473 2/20 0.45
HPGD P15428 2/20 0.43
XBP1 P17861 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
MEN1 O00255 1/20 0.42
ABCB1 P08183 2/20 0.41
MAPT P10636 1/20 0.41
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
DHODH Q02127 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL29701288 0.89 HPGD (0.54) ALDH1A1TSHRHPGDXBP1SIRT2
SCHEMBL4337394 0.89 ALDH1A1 (0.53) ALDH1A1TSHRSIRT2KMT2AHTT
Bicarbonate SCHEMBL29983441 0.87 HPGD (0.52) ALDH1A1TSHRHPGDXBP1SIRT2
SCHEMBL4343858 0.85 ESR1 (0.51) ALDH1A1KMT2AHTTMEN1MAPT
Bicarbonate SCHEMBL7114860 0.83 ESR1 (0.50) ALDH1A1KMT2AMEN1MAPT
SCHEMBL5155893 0.82 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL4342985 0.82 IRAK4 (0.54) ALDH1A1TSHRHPGDXBP1KMT2A
SCHEMBL7926507 0.81 ALDH1A1 (0.51) ALDH1A1TSHRHPGDKMT2AHTT
SCHEMBL5157734 0.81 MEN1 (0.51) ALDH1A1TSHRKMT2AMEN1MAPT
SCHEMBL235783 0.81 ALDH1A1 (0.55) ALDH1A1TSHRHPGDSIRT2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3247734-B1 PREPARATION OF HIGHLY HEAT-RESISTANT (EO)POIYCARBONATES BY THE TRANSESTERIFICATION METHOD COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-08-31 EP disclosed
US-10370491-B2 Preparation of highly heat-resistant (co)polycarbonates by the transesterification method COVESTRO DEUTSCHLAND AG (DE) 2019-08-06 US disclosed
US-20170369642-A1 Preparation of Highly Heat-Resistant (Co)Polycarbonates by the Transesterification Method COVESTRO DEUTSCHLAND AG (DE) 2017-12-28 US disclosed
EP-3247734-A1 PREPARATION OF HIGHLY HEAT-RESISTANT (EO)POIYCARBONATES BY THE TRANSESTERIFICATION METHOD Covestro Deutschland AG (DE) 2017-11-29 EP disclosed
WO-2016116480-A1 PREPARATION OF HIGHLY HEAT-RESISTANT (EO)POIYCARBONATES BY THE TRANSESTERIFICATION METHOD COVESTRO DEUTSCHLAND AG (DE) 2016-07-28 WO disclosed
US-20090117314-A1 PROCESS FOR THE PREPARATION OF POLYCARBONATE BY THE MELT TRANSESTERIFICATION METHOD BAYER MATERIALSCIENCE AG (DE) 2009-05-07 US disclosed