SCHEMBL52681

SCHEMBL52681

CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.58
FBP1 P09467 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
MAOB P27338 2/20 0.47
BCHE P06276 1/20 0.47
APP P05067 1/20 0.47
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
CES1 P23141 2/20 0.46
MAOA P21397 1/20 0.45
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
BRAF P15056 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
SCHEMBL17009045 1.00 AKR1C3 (0.58) AKR1C3FBP1MEN1KMT2AMAPK1
SCHEMBL481147 1.00 AKR1C3 (0.58) AKR1C3FBP1MEN1KMT2AMAPK1
Methacrylic Acid SCHEMBL28231449 0.94 AKR1C3 (0.51) AKR1C3FBP1MEN1KMT2AMAPK1
SCHEMBL28313969 0.87 FBP1 (0.56) FBP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL7882453 0.84 GLO1 (0.48) AKR1C3FBP1MEN1KMT2AMAPK1
SCHEMBL9065473 0.84 MAPT (0.60) FBP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL11101235 0.84 FBP1 (0.62) FBP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL11101232 0.84 FBP1 (0.62) FBP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8009563 0.84 MAPT (0.60) FBP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL9850705 0.83 FBP1 (0.59) FBP1MEN1KMT2AMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114381156-B Metal oxide dispersion composition, method for producing same, film composition containing same, optical film, and optical element 凯斯科技股份有限公司 2024-03-12 CN claimed
CN-114656818-A Metal oxide dispersion 凯斯科技股份有限公司 2022-06-24 CN claimed
CN-114381156-A Metal oxide dispersion composition, method for producing same, film composition containing same, optical film, and optical element 凯斯科技股份有限公司 2022-04-22 CN claimed
CN-111991563-A PH response type nano-drug delivery system and preparation method thereof 西北师范大学 2020-11-27 CN claimed
CN-105061701-B There is the active block copolymer of targeting anti-tumor and its preparation and the application as antineoplastic drug carrier containing hydrazone bond 西北师范大学 2018-07-20 CN claimed
CN-105061701-A Hydrazone bond-containing block copolymer having targeting antitumor activity and preparation thereof, and applications of block copolymer as antitumor drug carrier UNIV NORTHWEST NORMAL 2015-11-18 CN claimed
US-7927781-B2 Photosensitive resin composition, method for preparing the same, and dry film resist comprising the same DONGJIN SEMICHEM CO., LTD. (KR) 2011-04-19 US claimed
US-7919222-B2 Coating compositions for use with an overcoated photoresist ROHM AND HAAS ELECTRONICS MATERIALS LLC (US) 2011-04-05 US claimed
US-20100273931-A1 DECARBOXYLATING BLOCK COPOLYMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-28 US claimed
US-20090136872-A1 PHOTOSENSITIVE RESIN COMPOSITION, METHOD FOR PREPARING THE SAME, AND DRY FILM RESIST COMPRISING THE SAME DONGJIN SEMICHEM CO., LTD. (KR) 2009-05-28 US claimed
WO-2007123324-A1 PASTE COMPOSITION FOR PRINTING DONGJIN SEMICHEM CO., LTD (KR) 2007-11-01 WO claimed
WO-2007119955-A1 PASTE COMPOSITION FOR PRINTING DONGJIN SEMICHEM CO., LTD (KR) 2007-10-25 WO claimed
EP-1747059-A1 PERVAPORATION COMPOSITE MEMBRANES McMaster University (CA) 2007-01-31 EP claimed
US-20060000778-A1 high-performance membrane designed for the selective removal of a polar fluid (water) from less polar fluids (organic solvents), by a pervaporation using a composite membrane contaiing ultrafiltration membrane as support ( e.g. cellulose acetate) and a crosslinked copolymer of anionic, cationic monomers MCMASTER UNIVERSITY (CA) 2006-01-05 US claimed
WO-2005102503-A1 PERVAPORATION COMPOSITE MEMBRANES MCMASTER UNIVERSITY (CA) 2005-11-03 WO claimed
EP-0974607-B1 Coating compositions and inks DU PONT (US) 2004-09-29 EP claimed
EP-0974626-B1 Aqueous pigmented ink jet inks for printing on vinyls DU PONT (US) 2004-05-19 EP claimed
EP-0826751-B1 Aqueous dispersions containing graft copolymers as the dispersant DU PONT (US) 2004-04-28 EP claimed
US-4748161-A Triterpenyl esters of organic acids and hypolipidemic agents composed of them AMANO PHARMACEUTICAL CO., LTD. (JP) 1988-05-31 US claimed
EP-0166542-A2 Triterpenyl esters of organic acids, process for their production, and hypolipidemic agents composed of them AMANO PHARMACEUTICAL CO., LTD. (JP) 1986-01-02 EP claimed