SCHEMBL51938

SCHEMBL51938

O=C(O)c1ccc(C[N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.55
ALDH1A1 P00352 3/20 0.52
SRD5A2 P31213 3/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
FBP1 P09467 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CASP6 P55212 1/20 0.46
PLA2G4B P0C869 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
NR4A1 P22736 1/20 0.43
APEX1 P27695 1/20 0.43

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
SCHEMBL9322428 0.82 LOXL2 (0.42) ALDH1A1TSHRCA1CA2POLB
SCHEMBL9826959 0.82 ALDH1A1 (0.57) TDP1ALDH1A1TSHRCA1CA2
SCHEMBL3390982 0.80 TDP1 (0.52) TDP1ALDH1A1SRD5A2TP53TSHR
SCHEMBL11779027 0.79 CASP6 (0.41) TDP1ALDH1A1SRD5A2TP53TSHR
SCHEMBL27927344 0.79 KMT2A (0.41) ALDH1A1CA1CA2PLA2G4BKMT2A
SCHEMBL1641703 0.77 FOLH1 (0.58) TP53FBP1KMT2AHIF1A
SCHEMBL6795273 0.77 RARB (0.53) TDP1ALDH1A1SRD5A2TP53TSHR
SCHEMBL27817847 0.77 KMT2A (0.40) ALDH1A1CA1CA2KMT2AMEN1
SCHEMBL28748089 0.77 LOXL2 (0.58) TDP1TSHRCA1CA2KMT2A
SCHEMBL16311740 0.77 PGR (0.38) TDP1ALDH1A1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212375-B1 MODERATED REDUCTION REACTIONS FOR PRODUCING ARYLHYDROXYLAMINES MicroSi, Inc. (a Delaware corporation) (US) 1993-06-16 EP claimed
US-4723030-A ACID CATALYTIC HYDROGENATION OF NITROAROMATIC COMPOUNDS GENERAL ELECTRIC COMPANY (US) 1988-02-02 US claimed
EP-0212375-A1 Moderated reduction reactions for producing arylhydroxylamines MicroSi, Inc. (a Delaware corporation) (US) 1987-03-04 EP claimed
CN-120208799-A Preparation method of tranexamic acid 上海现代哈森(商丘)药业有限公司 2025-06-27 CN disclosed
CN-109912423-A A kind of green synthesis process of 3,5- dinitro -4- methyl benzoic acid 常州工程职业技术学院 2019-06-21 CN disclosed
CN-102131804-B Insecticidal compounds SYNGENTA PARTICIPATIONS AG 2014-12-03 CN disclosed
CN-103097340-A Therapeutically active compositions and methods of use thereof AGIOS PHARMACEUTICALS INC 2013-05-08 CN disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
CN-1989113-B Quinazoline derivatives NOVARTIS AG 2011-02-16 CN disclosed
EP-1633711-B1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF (1R,2S,5S)-6,6-DIMETHYL-3-AZABICYCLO[3,1,0]HEXANE-2-CARBOXYLATES OR SALTS THEREOF SCHERING CORP (US) 2010-11-24 EP disclosed
US-6677275-B1 Thermal recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2004-01-13 US disclosed
US-6551961-B1 Having high sensitivity in color development and a high whiteness of the background; image retention, heat resistance NIPPON PAPER INDUSTRIES CO LTD (JP) 2003-04-22 US disclosed
US-6407036-B1 MIXTURE OF FATTY AMIDE AND DIPHENYL SULFONE COMPOUND NIPPON PAPER INDUSTRIES CO. LTD (JP) 2002-06-18 US disclosed
EP-1092553-A1 THERMAL RECORDING MATERIAL NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2001-04-18 EP disclosed
EP-1092552-A1 THERMAL RECORDING MATERIAL NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2001-04-18 EP disclosed
US-6207794-B1 USING PHOSPHAZENIUM CATALYST MITSUI CHEMICAL, INC. (JP) 2001-03-27 US disclosed
EP-1080939-A1 THERMAL RECORDING MATERIAL NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2001-03-07 EP disclosed
EP-0916686-A1 POLYOXYALKYLENEPOLYOLS, DERIVATIVES THEREOF, AND PROCESS FOR PRODUCING THE POLYOXYALKYLENEPOLYOLS Mitsui Chemicals, Inc. (JP) 1999-05-19 EP disclosed
US-4709107-A Process for producing nitrones GENERAL ELECTRIC COMPANY (US) 1987-11-24 US disclosed