SCHEMBL1172467

SCHEMBL1172467

O=[N+]([O-])c1n[nH]c([N+](=O)[O-])n1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
MITF O75030 1/20 0.31
ALPL P05186 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
APEX1 P27695 1/20 0.31
APOBEC3A P31941 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
GALR3 O60755 1/20 0.31

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
SCHEMBL6131347 0.98 CYP1A2 (0.39) CYP1A2CYP2C9MITFALPLPOLB
Potassium SCHEMBL6131371 0.98 CYP1A2 (0.39) CYP1A2CYP2C9MITFALPLPOLB
Ammonia Solution, Strong SCHEMBL9727420 0.98 CYP1A2 (0.39) CYP1A2CYP2C9MITFALPLPOLB
Potassium Ion SCHEMBL6131368 0.98 CYP1A2 (0.39) CYP1A2CYP2C9MITFALPLPOLB
Ammonia Solution, Strong SCHEMBL9727425 0.82 CYP1A2 (0.36) CYP1A2CYP2C9
SCHEMBL6131370 0.82 CYP1A2 (0.36) CYP1A2CYP2C9
SCHEMBL6131346 0.82 CYP1A2 (0.36) CYP1A2CYP2C9
SCHEMBL28209261 0.82 CYP1A2 (0.43) CYP1A2CYP2C9MAPT
SCHEMBL9471612 0.82 CYP1A2 (0.31) CYP1A2CYP2C9
SCHEMBL9476367 0.82 CYP1A2 (0.31) CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117800797-A Hydroxylamine nitrate monocomponent propellant and preparation method thereof 中国航天科技创新研究院 2024-04-02 CN claimed
CN-115403430-A ADN (azodicarbonamide) synergistic moisture absorption preventing composite material and preparation method thereof 湖北航天化学技术研究所 2022-11-29 CN claimed
CN-109053614-B Triazine cation group nitrogen-rich energetic ionic salt and preparation method and application thereof 西南科技大学 2020-11-10 CN claimed
CN-103237870-B Process for removing metals from hydrocarbons 英国贝尔法斯特女王大学 2016-08-24 CN claimed
US-9309266-B2 High-performing stable green replacements for ammonium perchlorate UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2016-04-12 US claimed
US-20140350266-A1 High-Performing Stable Green Replacements for Ammonium Perchlorate UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2014-11-27 US claimed
CN-102574250-A Soldering process using electrodeposited indium and/or gallium, and article comprising an intermediate layer with indium and/or gallium ASTRON ADVANCED MATERIALS LTD 2012-07-11 CN claimed
US-7686901-B2 Gas generant compositions AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) 2010-03-30 US claimed
US-20090199937-A1 GAS GENERANT COMPOSITIONS DEUTSCHE BANK TRUST COMPANY AMERICAS, AS SECURITY AGENT FOR THE SECURED PARTIES 2009-08-13 US claimed
EP-1678006-A4 FILTERLESS AIRBAG MODULE AUTOMOTIVE SYSTEMS LAB (US) 2007-04-04 EP claimed
US-20050082804-A1 Filterless airbag module AUTOMOTIVE SYSTEMS LABORATORY, INC. 2005-04-21 US claimed
EP-0915813-A4 THERMALLY STABLE NONAZIDE AUTOMOTIVE AIRBAG PROPELLANTS AUTOMOTIVE SYSTEMS LAB (US) 2003-04-02 EP claimed
US-20020156291-A1 Process for the synthesis and recovery of nitramines ORBITAL ATK, INC. (F/K/A ALLIANT TECHSYSTEMS INC.) 2002-10-24 US claimed
WO-2002060881-A1 PROCESS FOR THE SYNTHESIS AND RECOVERY OF NITRAMINES ALLIANT TECHSYSTEMS INC. (US) 2002-08-08 WO claimed
US-6306232-B1 SUITABLE FOR INFLATING AIR BAGS IN PASSENGER-RESTRAINT DEVICES AUTOMOTIVE SYSTEMS LABORATORY, INC. 2001-10-23 US claimed
EP-0915813-A1 THERMALLY STABLE NONAZIDE AUTOMOTIVE AIRBAG PROPELLANTS AUTOMOTIVE SYSTEMS LABORATORY INC. (US) 1999-05-19 EP claimed
WO-1998004507-A1 THERMALLY STABLE NONAZIDE AUTOMOTIVE AIRBAG PROPELLANTS AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) 1998-02-05 WO claimed
WO-1994002434-A1 EXPLOSIVE BODY FÖRSVARETS FORSKNINGSANSTALT (SE) 1994-02-03 WO claimed
US-4300962-A Ammonium nitrate explosive systems THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1981-11-17 US claimed
US-4236014-A Production of the ammonium salt of 3,5-dinitro-1,2,4-triazole by solvent extraction THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1980-11-25 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-20020156291-A1 Process for the synthesis and recovery of nitramines NNMT, PNMT, NISCH CYP1A2 507/4885CYP2C9 777/4885MITF 2245/4885

“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.