SCHEMBL427393

SCHEMBL427393

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

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.56
GAA P10253 4/20 0.56
TP53 P04637 1/20 0.52
MAPT P10636 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
SLC6A3 Q01959 1/20 0.51
RAB9A P51151 1/20 0.50
HTT P42858 1/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL1345244 1.00 KMT2A (0.56) KMT2AGAATP53MAPTL3MBTL1
SCHEMBL1345434 1.00 KMT2A (0.56) KMT2AGAATP53MAPTL3MBTL1
SCHEMBL3529478 0.84 SLC6A3 (0.56) KMT2AGAAMAPTSLC6A3MEN1
SCHEMBL2874789 0.84 SLC6A3 (0.52) KMT2AGAAMAPTSLC6A3HTT
SCHEMBL4136472 0.83 ALDH1A1 (0.58) KMT2AGAAMAPTL3MBTL1RAB9A
SCHEMBL9309607 0.83 SLC6A3 (0.49) KMT2AGAATP53MAPTSLC6A3
SCHEMBL22838115 0.83 SLC6A3 (0.49) KMT2AGAATP53MAPTSLC6A3
SCHEMBL8593569 0.83 MEN1 (0.59) KMT2AGAAMAPTSLC6A3MEN1
SCHEMBL2614715 0.83 MEN1 (0.59) KMT2AGAAMAPTSLC6A3MEN1
SCHEMBL550633 0.82 KMT2A (0.52) KMT2AGAATP53MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743082-A1 CARBAZOLE COMPOUNDS AND THEIR USE IN THERAPY, IN THE TREATMENT OF A RESPIRATORY INFECTION UCL Business Ltd (GB) 2026-05-20 EP disclosed
WO-2025012634-A1 CARBAZOLE COMPOUNDS AND THEIR USE IN THERAPY, IN THE TREATMENT OF A RESPIRATORY INFECTION UCL BUSINESS LTD (GB) 2025-01-16 WO disclosed
US-20220062428-A1 Prodrugs with a tridentate self-immolative linker THE GENERAL HOSPITAL CORPORATION 2022-03-03 US disclosed
US-20170191986-A1 Compounds and Method of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators HMI Medical Innovations, LLC 2017-07-06 US disclosed
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-8604029-B2 2-[(2-substituted)-indolizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD BRITISH BODY CORPORATE (GB) 2013-12-10 US disclosed
US-20130273004-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2013-10-17 US disclosed
US-8247556-B2 Method for preparing 6-substituted-7-aza-indoles AMGEN INC. (US) 2012-08-21 US disclosed
US-8247556-B2 Method for preparing 6-substituted-7-aza-indoles AMGEN INC. (US) 2012-08-21 US disclosed
US-20070185171-A1 Compounds and methods of use AMGEN INC. 2007-08-09 US disclosed
CN-1319957-C Dithiazole compounds, matrix metalloprotease inhibitors and external preparations for the skin SHISEIDO CO LTD (JP) 2007-06-06 CN disclosed
WO-2007048070-A2 PYRROLO-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER DISEASES AMGEN INC. (US) 2007-04-26 WO disclosed
US-20040236111-A1 Dithiazole compounds, matrix metalloprotease inhibitors and external preparations for the skin SHISEIDO CO., LTD. (JP) 2004-11-25 US disclosed
CN-1549809-A Dithiazole compounds, matrix metalloprotease inhibitors and external preparations for the skin ������������ʽ���� 2004-11-24 CN disclosed
EP-1422224-A1 DITHIAZOLE COMPOUNDS, MATRIX METALLOPROTEASE INHIBITORS AND EXTERNAL PREPARATIONS FOR THE SKIN Shiseido Co., Ltd. (JP) 2004-05-26 EP disclosed
US-4650810-A OR INDOLE-5-THIOACETAMIDES GLAXO GROUP LIMITED (GB) 1987-03-17 US disclosed
EP-0077662-B1 PREPARATION OF NITROARYLACETIC ACID ESTERS AND DERIVATIVES THEREOF ETHYL CORPORATION (US) 1985-10-02 EP disclosed
US-4476315-A NITROARYLACETIC ACID ESTERS FROM NITROAROMATIC COMPOUNDS ETHYL CORPORATION (US) 1984-10-09 US disclosed
EP-0077662-A1 Preparation of nitroarylacetic acid esters and derivatives thereof ETHYL CORPORATION (US) 1983-04-27 EP 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 (4 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-20220062428-A1 Prodrugs with a tridentate self-immolative linker DNTT, SLC29A1, TK1 KMT2A 2908/4885GAA 472/4885TP53 719/4885
US-20040236111-A1 Dithiazole compounds, matrix metalloprotease inhibitors and external preparations for the skin MMP1, MMP2, MMP3 KMT2A 2099/4885GAA 785/4885TP53 2745/4885
US-20130273004-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AADAC, NAT1, PIGO KMT2A 1046/4885GAA 999/4885TP53 663/4885
US-20070185171-A1 Compounds and methods of use VHL, PGF, PTGIS KMT2A 3897/4885GAA 57/4885TP53 182/4885

“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.