SCHEMBL513738

SCHEMBL513738

O=CNc1ccccc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 2/20 0.56
CASP7 P55210 1/20 0.56
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
RAB9A P51151 6/20 0.51
NPC1 O15118 5/20 0.51
MAPT P10636 8/20 0.50
GAA P10253 2/20 0.50
PKM P14618 1/20 0.50
KAT2B Q92831 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
KCNMA1 Q12791 1/20 0.46
HSD17B10 Q99714 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
SCHEMBL27757554 0.82 MAPK1 (0.55) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL27579455 0.82 MAPK1 (0.55) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL1270550 0.82 MAPK1 (0.55) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL4263360 0.82 ERN1 (0.45) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL7530234 0.82 TDP1 (0.60) MAPK1TDP1ALDH1A1MEN1KMT2A
SCHEMBL10551420 0.81 ALDH1A1 (0.53) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL950729 0.79 MAPK1 (0.60) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL13596863 0.79 TDP1 (0.40) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL397773 0.79 MAPK1 (0.77) MAPK1L3MBTL1TDP1ALDH1A1CASP7
SCHEMBL5780903 0.78 TDP1 (0.50) MAPK1L3MBTL1TDP1ALDH1A1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104530417-B A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof 厦门赛诺邦格生物科技股份有限公司 2017-09-08 CN claimed
CN-104530415-B A kind of different functionalization Y types polyethyleneglycol derivative, preparation method and its bio-related substance 厦门赛诺邦格生物科技股份有限公司 2017-09-01 CN claimed
US-20130052690-A1 PCR PRIMER AND METHOD FOR REDUCING NON-SPECIFIC NUCLEIC ACID AMPLIFICATION USING A PHOTOLABILE PROTECTING GROUP SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-02-28 US claimed
US-8232312-B2 Substituted arylsulphonylglycines, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-07-31 US claimed
EP-2125718-B1 NEW SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2010-09-15 EP claimed
US-20100130557-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-05-27 US claimed
EP-2125718-A2 NEW SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2009-12-02 EP claimed
WO-2008113760-A2 ARYLSULPHONYGLYCINE DERIVATIVES AS SUPPRESSORS OF THE INTERACTION OF GLYCOGEN PHOSPHORYLASE A WITH THE GL SUBUNIT OF GLYCOGEN-ASSOCIATED PROTEIN PHOSPHATASE 1 (PPL) FOR THE TREATMENT OF METABOLIC DISORDERS, PARTICULARY DIABETES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-09-25 WO claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
JP-3041358-A None JP disclosed
CN-116410189-B Pyrimido pyridine compound and medicinal composition and application thereof 中国科学院上海药物研究所 2024-08-06 CN disclosed
CN-118344325-A PI3K selective inhibitors 轩竹生物科技股份有限公司 2024-07-16 CN disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
WO-1997035926-A1 DYE MIXTURES CONTAINING THIENYL AND/OR THIAZOLAZO DYES BASF AKTIENGESELLSCHAFT (DE) 1997-10-02 WO disclosed
EP-0277376-B1 AROMATIC AMIDE GROUPS-CONTAINING DIAMINES AND POLYMERS IN WHICH THESE DIAMINES ARE INCORPORATED AKZO N.V. (NL) 1991-02-27 EP disclosed
JP-H0341358-A ANALYZING METHOD FOR ESTER OF 3-HYDROXY FATTY ACID CHISSO CORP 1991-02-21 JP disclosed
US-4127670-A ANTHELMINTIC BAYER AKTIENGESELLSCHAFT (DE) 1978-11-28 US disclosed
US-3987182-A NOVEL BENZIMIDAZOLES USEFUL AS ANTI-ANDROGENS SCHERING CORPORATION (US) 1976-10-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130052690-A1 PCR PRIMER AND METHOD FOR REDUCING NON-SPECIFIC NUCLEIC ACID AMPLIFICATION USING A PHOTOLABILE PROTECTING GROUP POLL, POLRMT, POLN MAPK1 3416/4885L3MBTL1 1459/4885TDP1 296/4885
US-20100130557-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 MAPK1 1128/4885L3MBTL1 3679/4885TDP1 666/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.