SCHEMBL4332805

SCHEMBL4332805

CC(C)(C)c1cccc(COC(=O)OCc2cccc(C(C)(C)C)c2O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.52
GABRA1 P14867 2/20 0.46
GABRB2 P47870 2/20 0.46
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.40
ALOX12 P18054 1/20 0.39
IAPP P10997 4/20 0.38
CYBB P04839 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NAMPT P43490 1/20 0.37
ALOX5 P09917 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
NLRP3 Q96P20 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL4334985 0.87 CA2 (0.42) CA2GABRA1GABRB2ATMNPSR1
SCHEMBL1787508 0.84 RXRA (0.42) CA2ATMNPSR1ALDH1A1TSHR
SCHEMBL17942298 0.82 GABRA1 (0.65) CA2GABRA1GABRB2IAPPCYBB
SCHEMBL57139 0.80 GABRA1 (0.67) CA2GABRA1GABRB2ATMNPSR1
Propane SCHEMBL28225674 0.78 GABRA1 (0.64) CA2GABRA1GABRB2ATMNPSR1
SCHEMBL11811398 0.78 CA2 (0.53) CA2GABRA1GABRB2ATMNPSR1
SCHEMBL676460 0.77 ALDH1A1 (0.46) CA2GABRA1GABRB2IAPPCYBB
SCHEMBL4975584 0.77 CA2 (0.52) CA2GABRA1GABRB2ATMNPSR1
SCHEMBL30501159 0.77 CA2 (0.52) CA2GABRA1GABRB2ATMNPSR1
SCHEMBL10427578 0.76 CA2 (0.52) CA2GABRA1GABRB2ATMIAPP

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