SCHEMBL1157034

SCHEMBL1157034

CC(C)(C)c1ccccc1-c1ccccc1OC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.50
ATM Q13315 1/20 0.50
BCHE P06276 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
NPSR1 Q6W5P4 2/20 0.40
RBP4 P02753 3/20 0.39
TSHR P16473 1/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
MAPT P10636 1/20 0.38
ELANE P08246 2/20 0.38
NAMPT P43490 1/20 0.38
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
P2RY1 P47900 1/20 0.36

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
SCHEMBL1157030 0.88 TDP1 (0.47) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL1156978 0.87 ATM (0.46) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL47808 0.85 TDP1 (0.65) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL31304747 0.85 TDP1 (0.65) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL1156866 0.85 TDP1 (0.40) TDP1ATMBCHEALDH1A1KDM4E
Iodide SCHEMBL4843567 0.85 KDM4E (0.46) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL7017642 0.83 FABP3 (0.44) TDP1ATMALDH1A1KDM4EGAA
SCHEMBL1157163 0.81 FABP3 (0.38) TDP1ATMALDH1A1KDM4ERXRA
SCHEMBL9298828 0.80 KDM4E (0.43) TDP1ATMBCHEALDH1A1KDM4E
SCHEMBL8765509 0.78 ALDH1A1 (0.53) TDP1ALDH1A1KDM4EAKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153776-B Copolycarbonate as support material in 3D printing 科思创德国股份有限公司 2021-03-12 CN disclosed
CN-107207845-B Copolycarbonate compositions comprising PE-waxes with improved processability 科思创德国股份有限公司 2021-03-12 CN disclosed
CN-107207846-B Copolycarbonate compositions comprising diglyceride with improved rheological and optical properties 科思创德国股份有限公司 2020-05-19 CN disclosed
US-20120231278-A1 POLYCARBONATE COMPOSITION HAVING IMPROVED FLAME RESISTANCE FOR EXTRUSION APPLICATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-09-13 US disclosed
US-7879967-B2 End groups containing alkylsiloxane substituted phenol compounds ; extrusion; molding materials BAYER MATERIALSCIENCE AG (DE) 2011-02-01 US disclosed
US-20090137709-A1 POLYOL-CONTAINING, FLAME-RESISTANT POLYCARBONATES, PROCESSES FOR PREPARING THE SAME AND PRODUCTS CONTAINING THE SAME BAYER MATERIALSCIENCE AG (DE) 2009-05-28 US disclosed
US-20080249234-A1 Modified Polycarbonates, Polyester Carbonates and Polyesters Having Improved Elongation Behaviour and Flame Resistance BAYER MATERIALSCIENCE AG (DE) 2008-10-09 US disclosed
US-6887970-B2 Method for producing polycarbonates BAYER AKTIENGESELLSCHAFT (DE) 2005-05-03 US disclosed
US-20040143088-A1 Method for producing polycarbonates COVESTRO DEUTSCHLAND AG (DE) 2004-07-22 US disclosed
US-20020177684-A1 Process for producing polycarbonates BAYER AKTIENGESELLSCHAFT (DE) 2002-11-28 US disclosed