SCHEMBL1596941

SCHEMBL1596941

O=C(Br)C(Br)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.54
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
MDM2 Q00987 1/20 0.48
LAP3 P28838 3/20 0.47
CPA1 P15085 3/20 0.47
CPA3 P15088 2/20 0.47
ANPEP P15144 1/20 0.47
FOLH1 Q04609 1/20 0.47
CPB1 P15086 1/20 0.47
CPB2 Q96IY4 1/20 0.47
SRR Q9GZT4 2/20 0.46
EPHX1 P07099 1/20 0.46
ACP3 P15309 1/20 0.46
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46

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
SCHEMBL4826192 0.84 CYP1A2 (0.61) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL17763412 0.84 CYP1A2 (0.56) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL490844 0.84 CYP1A2 (0.61) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL4316458 0.84 CYP1A2 (0.61) CYP1A2ALPIPKMPTGS1XIAP
Bromide SCHEMBL1596942 0.83 CYP1A2 (0.59) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL5246633 0.81 EPHX1 (0.58) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL3713994 0.81 ALPI (0.53) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL27597075 0.81 EPHX1 (0.58) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL1173417 0.81 CYP1A2 (0.52) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL27626584 0.81 CYP1A2 (0.52) CYP1A2ALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1780224-B1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO (JP) 2015-02-18 EP disclosed
US-8710165-B2 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2014-04-29 US disclosed
US-20110152388-A1 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2011-06-23 US disclosed
US-7919570-B2 narrowly dispersed; controlled molecular weight; ionic conductivity, shape stability; battery adhesive or binder; 1,1,2,2-tetrakis(4-hydroxyphenyl)ethane or pentaerythritol reacted with bromoisobutyroyl bromide for core; living radical polymerization of acrylate or a styrene at halogen atoms as the arms NIPPON SODA CO., LTD. (JP) 2011-04-05 US disclosed
CN-101593852-B Multibranched polymers and process for production thereof NIPPON SODA CO 2011-03-02 CN disclosed
CN-101593852-A Multibranched polymers and manufacture method thereof NIPPON SODA CO (JP) 2009-12-02 CN disclosed
US-20080214685-A1 Multibrached Polymer and Method for Producing the Same NIPPON SODA CO., LTD. (JP) 2008-09-04 US disclosed
CN-101001887-A Multi-branched polymer and method for producing same NIPPON SODA CO (JP) 2007-07-18 CN disclosed
EP-1780224-A1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO., LTD. (JP) 2007-05-02 EP disclosed