SCHEMBL714242

SCHEMBL714242

COc1ccc(/C=C/C=O)c(OC)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 14/20 0.75
CYP1A1 P04798 13/20 0.75
CYP1B1 Q16678 13/20 0.75
ALDH1A1 P00352 3/20 0.70
NFE2L2 Q16236 2/20 0.66
MAPT P10636 3/20 0.65
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
CYP3A4 P08684 2/20 0.62
CYP2C19 P33261 2/20 0.62
CYP2E1 P05181 1/20 0.62
CYP2C8 P10632 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2A6 P11509 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP4B1 P13584 1/20 0.62
CYP2B6 P20813 1/20 0.62
CYP3A5 P20815 1/20 0.62
CYP2A7 P20853 1/20 0.62
CYP3A7 P24462 1/20 0.62

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
SCHEMBL29575647 1.00 CYP1A2 (0.75) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL4624144 1.00 CYP1A2 (0.75) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL1426024 0.93 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL29915985 0.93 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL1426026 0.93 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL24017227 0.88 CYP1A2 (0.58) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL5877571 0.87 CYP1A1 (0.69) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL2121298 0.87 CYP1A1 (0.69) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL26924044 0.86 CYP1A2 (0.84) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL25706432 0.86 CYP1A2 (1.00) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106831383-A Diarylheptanoids 中国科学院成都生物研究所 2017-06-13 CN disclosed
CN-106806361-A The new application of Diarylheptanoids 中国科学院成都生物研究所 2017-06-09 CN disclosed
US-20140178606-A1 CELLULOSE ACYLATE FILM, POLARIZER, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2014-06-26 US disclosed
US-8598228-B2 Cinnamic acid ascorbates MERCK PATENT GMBH (DE) 2013-12-03 US disclosed
US-8477275-B2 Optical film and liquid crystal display device FUJIFILM CORPORATION (JP) 2013-07-02 US disclosed
US-20130128359-A1 OPTICAL FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY APPARATUS FUJIFILM CORPORATION (JP) 2013-05-23 US disclosed
US-8420187-B2 Cellulose acylate composition, cellulose acylate film, and its applications FUJIFILM CORPORATION (JP) 2013-04-16 US disclosed
CN-102445730-A Optical film, polarizing plate and liquid crystal display device FUJIFILM CORP 2012-05-09 CN disclosed
US-20120092594-A1 OPTICAL FILM AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-04-19 US disclosed
US-20120092595-A1 Optical film, polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-19 US disclosed
CN-1158270-C Bipiperazine derivatives with calcium ion antagon action 四川大学 2004-07-21 CN disclosed
EP-1045842-B1 METHODS OF USE AND COMPOSITIONS FOR BENZYLIDENE- AND CINNAMYLIDENE-ANABASEINES UNIV FLORIDA (US) 2003-05-14 EP disclosed
US-6548096-B1 Aspartyl dipeptide ester derivatives and sweeteners AJINOMOTO CO., INC. (JP) 2003-04-15 US disclosed
CN-1342649-A Bipiperazine derivatives with calcium ion antagon action ZHONGPU BIO TECHNOLOGY CO LTD (CN) 2002-04-03 CN disclosed
EP-1070726-A1 ASPARTYL DIPEPTIDE ESTER DERIVATIVES AND SWEETENERS Ajinomoto Co., Inc. (JP) 2001-01-24 EP disclosed
EP-1045842-A2 METHODS OF USE AND COMPOSITIONS FOR BENZYLIDENE- AND CINNAMYLIDENE-ANABASEINES University of Florida (US) 2000-10-25 EP disclosed
US-5977144-A Methods of use and compositions for benzylidene- and cinnamylidene-anabaseines UNIVERSITY OF FLORIDA (US) 1999-11-02 US disclosed
WO-1999010338-A2 BENZYLIDENE- AND CINNAMYLIDENE-ANABASEINES AS NEURONAL NICOTINIC ALPHA-7 RECEPTOR AGONISTS UNIVERSITY OF FLORIDA (US) 1999-03-04 WO disclosed
US-5505936-A ANTI-SUNTAN OR ANTI-SUNBURN OIL BASED COSMETICS KAO CORPORATION (JP) 1996-04-09 US disclosed
EP-0629630-A1 Novel phosphoric diesters which absorb UV rays, method of preparing the same, and cosmetic compositions containing the same KAO CORPORATION (JP) 1994-12-21 EP disclosed