SCHEMBL2081799

SCHEMBL2081799

CC(C)(C)C(C(=O)OO)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 2/20 0.50
HPGD P15428 1/20 0.47
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
NPC1 O15118 1/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
CES1 P23141 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
PHLPP2 Q6ZVD8 1/20 0.41

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
SCHEMBL28486014 0.80 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDADRB2ADRB1
SCHEMBL7589576 0.76 L3MBTL1 (0.69) ADRB2ADRB1ADRB3KMT2AMEN1
SCHEMBL2079616 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDADRB2ADRB1
SCHEMBL3527114 0.73 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDADRB2ADRB1
SCHEMBL550633 0.72 KMT2A (0.52) ALDH1A1KDM4EHPGDMAPTKMT2A
SCHEMBL6609952 0.71 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDADRB2ADRB1
SCHEMBL8370315 0.71 MAPT (0.45) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL3529478 0.70 SLC6A3 (0.56) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL2874789 0.70 SLC6A3 (0.52) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL22838115 0.70 SLC6A3 (0.49) ALDH1A1KDM4EADRB2ADRB1ADRB3

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3253561-B1 PROCESS FOR PRODUCING MODIFIED OLEFIN POLYMER IN AN EXTRUDER BOREALIS AG (AT) 2019-05-08 EP claimed
CN-116323174-A Multilayer sheet comprising a foamed layer suitable for food packaging 北欧化工公司 2023-06-23 CN disclosed
CN-110753726-B Polypropylene composition with excellent surface appearance 博里利斯股份公司 2022-05-03 CN disclosed
CN-110520168-B Soft polypropylene compositions with improved properties 北欧化工公司 2021-12-14 CN disclosed
CN-109890892-B High flow heterophasic polypropylene copolymers with improved mechanical and optical properties 博里利斯股份公司 2021-11-16 CN disclosed
CN-109642065-B Rigid propylene compositions with good dimensional stability and excellent surface appearance 博里利斯股份公司 2021-07-27 CN disclosed
CN-108137886-B Long chain branched polypropylene compositions with increased melt strength stability 博里利斯股份公司 2021-05-04 CN disclosed
CN-110753726-A Polypropylene composition with excellent surface appearance 博里利斯股份公司 2020-02-04 CN disclosed
US-9431172-B2 Biaxially oriented electrical insulating film BOREALIS TECHNOLOGY OY (FI) 2016-08-30 US disclosed
CN-104073190-B Acrylic polymers adhesive composition suitable in extrusion coating paper substrates 北欧化工股份公司 2016-06-29 CN disclosed
EP-0930336-A1 Thermoplastic elastomers with good paintability, high resistance and elasticity and high impact resistant polymer blends prepared therefrom Borealis AG (AT) 1999-07-21 EP disclosed
EP-0915134-A2 Thermoplastic elastomer with high resistance, elasticity and good paintability and high impact resistant polymer blends prepared therefrom Borealis AG (AT) 1999-05-12 EP disclosed
EP-0884355-A1 Polyolefin foams with fine cells PCD Polymere AG (AT) 1998-12-16 EP disclosed
EP-0884335-A1 Segmented polyolefines PCD Polymere AG (AT) 1998-12-16 EP disclosed
EP-0879844-A1 Polyolefin foams with high resistance against deformation by heat PCD Polymere AG (AT) 1998-11-25 EP disclosed
EP-0879830-A1 Modified polypropylene having improved processability PCD Polymere AG (AT) 1998-11-25 EP disclosed
EP-0878567-A2 Polyolefin fibres and polyolefin yarns and textile materials thereof PCD Polymere AG (AT) 1998-11-18 EP disclosed
EP-0821018-A2 Crosslinkable olefinic polymers and method for their preparation PCD-Polymere Gesellschaft m.b.H. (AT) 1998-01-28 EP disclosed
EP-0792894-A2 Continuous modification of polyolefins in solid phase PCD-Polymere Gesellschaft m.b.H. (AT) 1997-09-03 EP disclosed
EP-0787750-A2 Poly(alkylethylene) structural isomers PCD-Polymere Gesellschaft m.b.H. (AT) 1997-08-06 EP disclosed