SCHEMBL5126783

SCHEMBL5126783

Cc1nccc(N)c1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
USP2 O75604 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
NPY1R P25929 3/20 0.41
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
CYP3A4 P08684 2/20 0.40
MAPT P10636 3/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL3688848 0.80 MAPT (0.47) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL30197316 0.80 ALDH1A1 (0.54) PKMKMT2AMEN1NPY1RALDH1A1
SCHEMBL843559 0.80 ALDH1A1 (0.54) PKMKMT2AMEN1NPY1RALDH1A1
SCHEMBL8561095 0.78 MEN1 (0.42) KMT2AMEN1USP2KEAP1NFE2L2
Ammonia Solution, Strong SCHEMBL27851817 0.78 ALDH1A1 (0.52) PKMKMT2AMEN1NPY1RALDH1A1
SCHEMBL18486948 0.78 KMT2A (0.42) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL18032590 0.77 ALDH1A1 (0.41) PKMKMT2AMEN1NPY1RALDH1A1
SCHEMBL4064206 0.77 MEN1 (0.41) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL414810 0.77 MEN1 (0.41) KMT2AMEN1USP2KEAP1NFE2L2
SCHEMBL203785 0.77 MEN1 (0.41) KMT2AMEN1USP2KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410125-A Preparation method of 2-methyl-3-nitro-4-hydroxypyridine 嘉兴逸泰生物科技有限公司 2023-07-11 CN claimed
EP-3746441-A1 PHARMACEUTICAL COMPOUND, SALTS THEREOF, FORMULATIONS THEREOF, AND METHODS OF MAKING AND USING SAME GENENTECH, INC. (US) 2020-12-09 EP claimed
WO-2019152863-A1 PHARMACEUTICAL COMPOUND, SALTS THEREOF, FORMULATIONS THEREOF, AND METHODS OF MAKING AND USING SAME GENENTECH, INC. (US) 2019-08-08 WO claimed
WO-2025101780-A1 PHARMACOLOGICAL CORRECTORS OF RHODOPSIN AND USES THEREOF OCTANT, INC. (US) 2025-05-15 WO disclosed
WO-2024215070-A1 PYRAZOLOPYRIDINE DERIVATIVE COMPOUND, AND USE THEREOF 보로노이 주식회사 2024-10-17 WO disclosed
CN-116410125-A Preparation method of 2-methyl-3-nitro-4-hydroxypyridine 嘉兴逸泰生物科技有限公司 2023-07-11 CN disclosed
CN-116410125-A Preparation method of 2-methyl-3-nitro-4-hydroxypyridine 嘉兴逸泰生物科技有限公司 2023-07-11 CN disclosed
US-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 US disclosed
CN-114921468-A Novel compound and method for producing regulatory T cell 国立大学法人京都大学 2022-08-19 CN disclosed
CN-110234648-B Novel compound and method for producing regulatory T cell 国立大学法人京都大学 2022-06-14 CN disclosed
CN-105916503-B Heteroaryl compounds and uses thereof 米伦纽姆医药公司 2020-04-14 CN disclosed
WO-2015108861-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-07-23 WO disclosed
US-20080058383-A1 Androgen Receptor Modulators KARO BIO AB (SE) 2008-03-06 US disclosed
EP-1685090-A1 ANDROGEN RECEPTOR MODULATORS KARO BIO AB (SE) 2006-08-02 EP disclosed
WO-2005042464-A1 ANDROGEN RECEPTOR MODULATORS KARO BIO AB (SE) 2005-05-12 WO disclosed
EP-0750620-A4 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO INC (US) 1997-07-16 EP disclosed
EP-0750620-A1 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO. INC. (US) 1997-01-02 EP disclosed
US-5496816-A Carbapenem antibacterial compounds, compositions containing such compounds and methods of treatment MERCK & CO., INC. (US) 1996-03-05 US disclosed
WO-1995025108-A1 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1995-09-21 WO disclosed
US-5302601-A Useful in the treatment of diseases mediated by platelet activating factor G. D. SEARLE & CO. (US) 1994-04-12 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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS EGFR, ERBB2, ERBB3 PKM 2484/4885KMT2A 3421/4885MEN1 2200/4885
US-20080058383-A1 Androgen Receptor Modulators NR5A1, ESRRA, AR PKM 1525/4885KMT2A 3314/4885MEN1 1458/4885

“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.