SCHEMBL4428838

SCHEMBL4428838

C=CCOC(=O)c1cccc(Br)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
MAPK1 P28482 1/20 0.55
TSHR P16473 2/20 0.54
LMNA P02545 1/20 0.54
CYP3A4 P08684 1/20 0.53
PARP1 P09874 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
CYP1A2 P05177 1/20 0.46
SNCA P37840 1/20 0.46
OGG1 O15527 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
CTDSP1 Q9GZU7 1/20 0.45

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
SCHEMBL31688807 1.00 KDM4E (0.55) KDM4EMAPK1TSHRLMNACYP3A4
SCHEMBL16372021 0.88 CYP3A4 (0.61) MAPK1TSHRLMNACYP3A4ALDH1A1
SCHEMBL157805 0.88 CYP3A4 (0.61) MAPK1TSHRLMNACYP3A4ALDH1A1
Benzene SCHEMBL29140663 0.86 CYP3A4 (0.59) KDM4EMAPK1TSHRLMNACYP3A4
SCHEMBL5663507 0.85 KDM4E (0.56) KDM4EMAPK1TSHRLMNAPARP1
SCHEMBL9576387 0.85 CYP3A4 (0.58) MAPK1TSHRCYP3A4ALDH1A1HSD17B10
SCHEMBL20762833 0.84 CYP3A4 (0.53) KDM4EMAPK1TSHRLMNACYP3A4
SCHEMBL6284521 0.83 CYP3A4 (0.56) TSHRCYP3A4HPGDALDH1A1HSD17B10
SCHEMBL8603488 0.83 CYP3A4 (0.50) KDM4ETSHRCYP3A4HPGDALDH1A1
SCHEMBL27362136 0.83 CYP3A4 (0.51) KDM4ETSHRCYP3A4SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1791824-A1 RADICALLY POLYMERIZABLE SULFUR-CONTAINING COMPOUND AND RADICALLY POLYMERIZABLE SULFUR-CONTAINING POLYMER Showa Denko K.K. (JP) 2007-06-06 EP claimed
WO-2006033438-A1 RADICALLY POLYMERIZABLE SULFUR-CONTAINING COMPOUND AND RADICALLY POLYMERIZABLE SULFUR-CONTAINING POLYMER SHOWA DENKO K.K. (JP) 2006-03-30 WO claimed
EP-1328560-A2 PLASTIC LENS COMPOSITION, PLASTIC LENS, AND PROCESS FOR PRODUCING THE PLASTIC LENS Showa Denko K.K. (JP) 2003-07-23 EP claimed
WO-2002026843-A2 PLASTIC LENS COMPOSITION, PLASTIC LENS, AND PROCESS FOR PRODUCING THE PLASTIC LENS SHOWA DENKO K. K. (JP) 2002-04-04 WO claimed
CN-113165257-A Apparatus for producing cured resin film and method for producing cured resin film 昭和电工株式会社 2021-07-23 CN disclosed
CN-105263687-B The manufacture device and manufacture method of light-cured resin film 昭和电工株式会社 2017-12-19 CN disclosed
CN-105263687-A Method for producing and device for producing photocurable resin film SHOWA DENKO KK 2016-01-20 CN disclosed
EP-2094654-A1 RADICALLY POLYMERIZABLE COMPOUND HAVING A DITHIOCARBONATE STRUCTURE AND A SULFUR-CONTAINING ALLYLCARBONATE Showa Denko K.K. (JP) 2009-09-02 EP disclosed
EP-1979383-A2 RADICALLY POLYMERIZABLE COMPOUND HAVING A CYCLIC DITHIOCARBONATE GROUP Showa Denko K.K. (JP) 2008-10-15 EP disclosed
WO-2008062903-A1 RADICALLY POLYMERIZABLE COMPOUND HAVING A DITHIOCARBONATE STRUCTURE AND A SULFUR-CONTAINING ALLYLCARBONATE SHOWA DENKO K.K. (JP) 2008-05-29 WO disclosed
WO-2007086607-A2 RADICALLY POLYMERIZABLE COMPOUND HAVING A CYCLIC DITHIOCARBONATE GROUP SHOWA DENKO K.K. (JP) 2007-08-02 WO disclosed
EP-1791824-A1 RADICALLY POLYMERIZABLE SULFUR-CONTAINING COMPOUND AND RADICALLY POLYMERIZABLE SULFUR-CONTAINING POLYMER Showa Denko K.K. (JP) 2007-06-06 EP disclosed
CN-1466598-A Plastic lens composition, plastic lens and method for producing the plastic lens �Ѻ͵繤��ʽ���� 2004-01-07 CN disclosed
EP-1328560-A2 PLASTIC LENS COMPOSITION, PLASTIC LENS, AND PROCESS FOR PRODUCING THE PLASTIC LENS Showa Denko K.K. (JP) 2003-07-23 EP disclosed
WO-2003010566-A2 PLASTIC LENS MATERIAL, PLASTIC LENS COMPOSITION, PLASTIC LENS OBTAINED BY CURING THE COMPOSITION AND PROCESS FOR PRODUCING THE PLASTIC LENS SHOWA DENKO K. K. (JP) 2003-02-06 WO disclosed
WO-2002026843-A2 PLASTIC LENS COMPOSITION, PLASTIC LENS, AND PROCESS FOR PRODUCING THE PLASTIC LENS SHOWA DENKO K. K. (JP) 2002-04-04 WO disclosed
US-5731432-A Inhibitors of adenosine monophosphate deaminase GENSIA SICOR INC. (US) 1998-03-24 US disclosed
EP-0683781-A4 NOVEL INHIBITORS OF ADENOSINE MONOPHOSPHATE DEAMINASE. GENSIA PHARMA (US) 1997-05-28 EP disclosed
EP-0683781-A1 NOVEL INHIBITORS OF ADENOSINE MONOPHOSPHATE DEAMINASE GENSIA PHARMACEUTICALS, INC. (US) 1995-11-29 EP disclosed
WO-1994018200-A1 NOVEL INHIBITORS OF ADENOSINE MONOPHOSPHATE DEAMINASE GENSIA, INC. (US) 1994-08-18 WO disclosed