SCHEMBL9516078

SCHEMBL9516078

O=Cc1ncc([N+](=O)[O-])[nH]1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL9517071 0.79 NPC1 (0.33) MAPTALDH1A1
SCHEMBL11473166 0.78 SLC2A1 (0.45) MAPTALDH1A1
SCHEMBL11473169 0.78 SLC2A1 (0.45) MAPTALDH1A1
SCHEMBL12441774 0.74 MAPT (0.35) MAPTALDH1A1
SCHEMBL29793430 0.74 ALDH1A1 (0.37) MAPTALDH1A1
SCHEMBL1187005 0.72
SCHEMBL11087844 0.72
SCHEMBL11839998 0.71 GLO1 (0.35) ALDH1A1
SCHEMBL11839992 0.71 GLO1 (0.35) ALDH1A1
SCHEMBL11825958 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2906216-B1 INHIBITORS OF DNA GYRASE FOR THE TREATMENT OF BACTERIAL INFECTIONS KUMAR AJAY (GB) 2020-06-24 EP disclosed
US-9643979-B2 Inhibitors of DNA gyrase for the treatment of bacterial infections VITAS PHARMA RESEARCH PRIVATE LIMITED (IN) 2017-05-09 US disclosed
US-20150284408-A1 INHIBITORS OF DNA GYRASE FOR THE TREATMENT OF BACTERIAL INFECTIONS KUMAR, AJAY, DR. (GB) 2015-10-08 US disclosed
EP-2906216-A2 INHIBITORS OF DNA GYRASE FOR THE TREATMENT OF BACTERIAL INFECTIONS Vitas Pharma Research Private Limited (IN) 2015-08-19 EP disclosed
WO-2014057415-A2 INHIBITORS OF DNA GYRASE FOR THE TREATMENT OF BACTERIAL INFECTIONS VITAS PHARMA RESEARCH PVT LTD (IN) 2014-04-17 WO disclosed
EP-0430001-B1 Process for preparing benzaldehydes BAYER AG (DE) 1993-12-22 EP disclosed
US-5082976-A PROCESS FOR THE PREPARATION OF BENZALDEHYDES BAYER AKTIENGESELLSCHAFT (DE) 1992-01-21 US disclosed
EP-0430001-A1 Process for preparing benzaldehydes BAYER AG (DE) 1991-06-05 EP disclosed
EP-0131043-A1 PROCESS FOR PRODUCING POLYNUCLEOTIDES Board of Trustees of Southern Illinois University (US) 1985-01-16 EP disclosed
WO-1984002526-A1 PROCESS FOR PRODUCING POLYNUCLEOTIDES UNIV SOUTHERN ILLINOIS (US) 1984-07-05 WO disclosed
US-4267349-A Process for the preparation of 2-substituted-alkyl-1-alkyl-nitroimidazoles BASF AKTIENGESELLSCHAFT (DE) 1981-05-12 US disclosed
US-4232165-A 2-Substituted-1-alkyl-nitroimidazoles BASF AKTIENGESELLSCHAFT (DE) 1980-11-04 US disclosed
US-4218460-A NITROIMIDAZOLYLVINYLTHIADIAZOLES; TREATMENT OF TRICHOMONIASIS, TRYPANOSOMIASIS, AMOEBIC DYSENTERY BASF AKTIENGESELLSCHAFT (DE) 1980-08-19 US disclosed
EP-0006463-A1 Process for the production of 2-substituted 1-alkyl-nitroimidazoles BASF Aktiengesellschaft (DE) 1980-01-09 EP disclosed
US-4080340-A Nitroimidazoles MERCK & CO., INC. (US) 1978-03-21 US disclosed
US-4010176-A Isoxazole substituted nitroimidazoles MERCK & CO., INC. (US) 1977-03-01 US disclosed
US-3973019-A Pharmaceutical compositions containing 1,4-bis-(5'-nitroimidazolyl-2'-methylene-imino) piperazine compounds for treating protozoal diseases and methods for treating such diseases HOECHST AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed
US-3973019-A Pharmaceutical compositions containing 1,4-bis-(5'-nitroimidazolyl-2'-methylene-imino) piperazine compounds for treating protozoal diseases and methods for treating such diseases HOECHST AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed
US-3960882-A IMIDAZOLYLPROPENOIC ACID ESTER MONTANARI ROBERTO 1976-06-01 US disclosed
US-3903081-A 1,4-Bis-(5{40 -nitroimidazolyl-2{40 -methylene-imino)-piperazines HOECHST AG 1975-09-02 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 (1 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-20150284408-A1 INHIBITORS OF DNA GYRASE FOR THE TREATMENT OF BACTERIAL INFECTIONS TOP1, TOP2A, DNASE1 MAPT 3965/4885ALDH1A1 3693/4885

“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.