SCHEMBL211857

SCHEMBL211857

O=C(O)c1nn[nH]c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
HAO1 Q9UJM8 14/20 0.38
HCAR2 Q8TDS4 4/20 0.35
CYP1A2 P05177 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CYP2C19 P33261 1/20 0.34
PIN1 Q13526 1/20 0.34

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
Water SCHEMBL6474736 0.98 LDHA (0.37) LDHALDHBHAO1HCAR2CYP1A2
SCHEMBL12050686 0.84 HAO1 (0.35) HAO1
Biguanide SCHEMBL28474366 0.83 HAO1 (0.31) HAO1
SCHEMBL2385273 0.79 KDM4C (0.46) HAO1HCAR2MAPK1
SCHEMBL5185712 0.79 KDM4C (0.46) HAO1MAPK1
SCHEMBL12050672 0.75
SCHEMBL6404716 0.75
SCHEMBL14672695 0.75 KDM5A (0.36) HCAR2MAPK1PIN1
SCHEMBL28728618 0.73 HAO1 (0.47) HAO1
SCHEMBL24310439 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119735559-A MOF-based alkaline earth metal phosphorescent material and preparation method and application thereof 河南地矿职业学院 2025-04-01 CN claimed
CN-119409649-A Synthesis method of 1,2, 3-triazole-4, 5-dicarboxylic acid 山西新天源药业有限公司 2025-02-11 CN claimed
CN-118878471-A Continuous preparation method and system of 1H-1,2, 3-triazole 青岛科技大学 2024-11-01 CN claimed
CN-118638092-A Preparation method of glycerol ketal 浙江博聚新材料有限公司 2024-09-13 CN claimed
US-20240123074-A1 MINIMALLY TOXIC PRODRUGS COBIORES NV (BE) 2024-04-18 US claimed
US-11932765-B2 Meltable intumescent flame retardant compositions QED LABS, INC. (US) 2024-03-19 US claimed
CN-116947769-A Preparation method of 1H-1,2, 3-triazole 江西祥太生命科学有限公司 2023-10-27 CN claimed
US-20230331986-A1 MELTABLE INTUMESCENT FLAME RETARDANT COMPOSITIONS QED LABS INC (US) 2023-10-19 US claimed
CN-114805839-B Ultraviolet wavelength detection material based on coordination polymer and application thereof 南开大学 2023-08-18 CN claimed
EP-4054739-A1 REGENERABLE VOC FILTERS WITH IMPROVED SELECTIVITY AND EFFICACY Ecole Nationale Supérieure d'Ingénieurs de Caen (FR) 2022-09-14 EP claimed
WO-2001095943-A2 PRODRUG COMPOUNDS WITH AN OLIGOPEPTIDE HAVING AN ISOLEUCINE RESIDUE MEDAREX, INC. (US) 2001-12-20 WO claimed
WO-2001095945-A2 PRODRUG COMPOUNDS CLEAVABLE BY THIMET OLIGOPEPTIDASE MEDAREX, INC. (US) 2001-12-20 WO claimed
EP-0673783-B1 Recording sheets containing purine, pyrimidine, benzimidazole, imidazolidine, urazole, pyrazole, triazole, benzotriazole, tetrazole, and pyrazine compounds XEROX CORP (US) 2000-07-05 EP claimed
EP-0998481-A1 PHOTOSENSITIZERS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2000-05-10 EP claimed
WO-1999003868-A1 PHOTOSENSITIZERS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1999-01-28 WO claimed
US-5659348-A APPLYING TO A SUBSTRATE XEROX CORPORATION (US) 1997-08-19 US claimed
WO-1997027360-A1 PHASE SEPARATION APPARATUS SCAPA GROUP PLC (GB) 1997-07-31 WO claimed
EP-0673783-A2 Recording sheets containing purine, pyrimidine, benzimidazole, imidazolidine, urazole, pyrazole, triazole, benzotriazole, tetrazole, and pyrazine compounds XEROX CORPORATION (US) 1995-09-27 EP claimed
US-4810397-A ALUMINUM COMPOUND, ACID, THIADIAZOLE OR TRIAZOLE UNION OIL COMPANY OF CALIFORNIA (US) 1989-03-07 US claimed
US-4719001-A ALUMINUM COMPOUND AND THIADIAZOLE DERIVATIVE UNION OIL COMPANY OF CALIFORNIA (US) 1988-01-12 US claimed

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-20240123074-A1 MINIMALLY TOXIC PRODRUGS ALG8, ALG1, LNPEP LDHA 755/4885LDHB 897/4885HAO1 4331/4885

“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.