SCHEMBL961470

SCHEMBL961470

O=[N+]([O-])OCCC(CO[N+](=O)[O-])O[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.34
PTGS1 P23219 2/20 0.34
ALDH1A1 P00352 1/20 0.33

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
Nitroglycerin SCHEMBL28548357 0.98 PTGS2 (0.36) PTGS2PTGS1ALDH1A1
SCHEMBL11782405 0.86 CA12 (0.35) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL15421 0.84 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL920644 0.84 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL3640987 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL28723109 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL7752031 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL7752036 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL10424193 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1
Nitroglycerin SCHEMBL3640991 0.82 PTGS2 (0.40) PTGS2PTGS1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3433086-B1 ENERGETIC MATERIALS TNO (NL) 2026-05-06 EP claimed
US-20260110607-A1 TRANSPORT AND DETECTION OF EXPLOSIVE SAMPLES WITH MINIMIZED FALSE POSITIVES ALTI LLC (US) 2026-04-23 US claimed
US-12517047-B2 Transport and detection of explosive samples ALTI LLC (US) 2026-01-06 US claimed
US-20250237601-A1 TRANSPORT AND DETECTION OF EXPLOSIVE SAMPLES ALTI LLC 2025-07-24 US claimed
CN-119977735-A High-energy solid propellant additive manufacturing method based on adhesive spraying 湖北航天化学技术研究所 2025-05-13 CN claimed
CN-119954845-A Dual-purpose boric acid ester bonding agent, and synthetic method and application thereof 湖北航天化学技术研究所 2025-05-09 CN claimed
US-12030965-B2 Modified conjugated diene based polymer, manufacturing method thereof, binder composition for solid propellant comprising the same, modified conjugated diene based binder for solid propellant, and manufacturing method thereof AGENCY FOR DEFENSE DEVELOPMENT (KR) 2024-07-09 US claimed
CN-115677438-B NEPE propellant slurry formula for melt extrusion molding 3D printing and preparation method 东南大学 2024-05-31 CN claimed
CN-117760905-A Method for estimating normal-temperature mechanical properties of high-plasticization PEG polyurethane elastomer 中国人民解放军国防科技大学 2024-03-26 CN claimed
CN-117466691-A Nitrocotton-based embedded porous propellant and preparation method thereof 南京理工大学 2024-01-30 CN claimed
US-5468313-A Plastisol explosive THIOKOL CORPORATION (US) 1995-11-21 US claimed
US-5463956-A Additive mixture of bismuth trioxide, plasticizer, terpene resin and oxidized waxes or their potassium salts ICI AMERICAS INC. (US) 1995-11-07 US claimed
US-H1459-H Cast-curable, polyurethane from a polyorthocarbonate diol and a diisocyanate THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1995-07-04 US claimed
EP-0553476-A1 Chlorine-free composite rocket propellant HERCULES INCORPORATED (US) 1993-08-04 EP claimed
US-5114506-A Gun propellants and explosive composites THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1992-05-19 US claimed
US-4909868-A High pressure spray system; extraction THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1990-03-20 US claimed
US-4799980-A PROPELLANTS AND EXPLOSIVES UNITED STATES OF AMERICA THE, AS REPRESENTED BY THE SECRETARY OF THE NAVY 1989-01-24 US claimed
US-H448-H Co-nitration of 1,2,4-butanetriol and glycerin THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1988-03-01 US claimed
US-4555277-A STORAGE STABLEW, PLASTIC URETHANE, PLASTICIZING THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITES STATES DEPARTMENT OF ENERGY (US) 1985-11-26 US claimed
US-4507161-A OXYGEN RELEASING SALT, EMULSIFIERS ICI AUSTRALIA LIMITED (AU) 1985-03-26 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-20260110607-A1 TRANSPORT AND DETECTION OF EXPLOSIVE SAMPLES WITH MINIMIZED FALSE POSITIVES TES, TNPO1, SLC2A1 PTGS2 394/4885PTGS1 370/4885ALDH1A1 4406/4885

“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.