SCHEMBL2945656

SCHEMBL2945656

O=C(NC1CCCCC1)OC(c1ccccc1)[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 2/20 0.52
TSHR P16473 2/20 0.51
EPHX1 P07099 4/20 0.48
LMNA P02545 1/20 0.48
FAAH O00519 2/20 0.45
HPGD P15428 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
GAA P10253 1/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL8341401 0.76 RAB9A (0.55) RAB9AALDH1A1TSHREPHX1LMNA
SCHEMBL771095 0.75 TSHR (0.59) RAB9AALDH1A1TSHREPHX1LMNA
SCHEMBL2674734 0.74 ALDH1A1 (0.53) RAB9AALDH1A1LMNAGAANPSR1
SCHEMBL2674274 0.74 KMT2A (0.53) RAB9AALDH1A1GAA
SCHEMBL286963 0.73 GSR (0.43) ALDH1A1LMNACYP3A4
SCHEMBL22323630 0.73 GSR (0.43) ALDH1A1LMNACYP3A4CYP2C19CNR1
Nitrobenzene SCHEMBL27526897 0.73 EPHX1 (0.56) RAB9AALDH1A1EPHX1HPGDGAA
SCHEMBL12508368 0.73 ALDH1A1 (0.56) RAB9AALDH1A1TSHRHPGDGAA
SCHEMBL2201239 0.73 ALDH1A1 (0.51) RAB9AALDH1A1LMNAGAANPSR1
SCHEMBL11568196 0.72 HTT (0.47) ALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1935042-A1 ORGANIC LIGHT EMITTING DEVICES HAVING LATENT ACTIVATED LAYERS AND METHODS OF FABRICATING THE SAME General Electric Company (US) 2008-06-25 EP claimed
WO-2007040728-A1 ORGANIC LIGHT EMITTING DEVICES HAVING LATENT ACTIVATED LAYERS AND METHODS OF FABRICATING THE SAME GENERAL ELECTRIC COMPANY (US) 2007-04-12 WO claimed
EP-4210883-B1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-02-14 EP disclosed
US-20230348667-A1 Investment Casting Compositions and Methods 3M INNOVATIVE PROPERTIES COMPANY 2023-11-02 US disclosed
EP-4210883-A1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M Innovative Properties Company (US) 2023-07-19 EP disclosed
EP-3548541-B1 DUAL CURE MONOMERS 3M INNOVATIVE PROPERTIES CO (US) 2022-05-18 EP disclosed
WO-2022053890-A1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-03-17 WO disclosed
US-11021574-B2 Dual cure monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-06-01 US disclosed
EP-3159737-B1 LIQUID CRYSTAL DISPLAY ELEMENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL ALIGNMENT TREATMENT AGENT NISSAN CHEMICAL CORP (JP) 2021-05-26 EP disclosed
US-10647816-B2 Liquid crystal display device NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2020-05-12 US disclosed
US-20200062908-A1 Dual Cure Monomers 3M INNOVATIVE PROPERTIES COMPANY 2020-02-27 US disclosed
EP-1508835-A2 Dye-containing resist composition and color filter using same NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2005-02-23 EP disclosed
CN-1584631-A Dye-containing resist composition and color filter using same NISSAN CHEMICAL IND LTD (JP) 2005-02-23 CN disclosed
US-6858374-B2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2005-02-22 US disclosed
US-20030068575-A1 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. 2003-04-10 US disclosed
EP-0882072-B1 ANIONIC PHOTOCATALYST DSM NV (NL) 2000-11-08 EP disclosed
US-6124371-A STABILITY AND GOOD SOLUBILITY IN POLYMERIZABLE MATERIAL DSM N.V. (NL) 2000-09-26 US disclosed
EP-0882072-A1 ANIONIC PHOTOCATALYST DSM N.V. (NL) 1998-12-09 EP disclosed
WO-1997031033-A1 ANIONIC PHOTOCATALYST DSM N.V. (NL) 1997-08-28 WO disclosed
EP-0425142-A2 Positive acting photoresist and method of producing same ROHM AND HAAS COMPANY (US) 1991-05-02 EP disclosed