SCHEMBL437092

SCHEMBL437092

O=[N+]([O-])OCCOCCOCCO[N+](=O)[O-]

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 4/20 0.34
CA4 P22748 4/20 0.34
CA9 Q16790 4/20 0.34
PTGS2 P35354 2/20 0.32
PTGS1 P23219 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
SCHEMBL439675 1.00 ALDH1A1 (0.46) ALDH1A1CA12CA1CA2CA4
SCHEMBL11792981 1.00 ALDH1A1 (0.46) ALDH1A1CA12CA1CA2CA4
SCHEMBL28277555 1.00 ALDH1A1 (0.46) ALDH1A1CA12CA1CA2CA4
SCHEMBL1773954 1.00 ALDH1A1 (0.46) ALDH1A1CA12CA1CA2CA4
SCHEMBL27281565 0.90 ALDH1A1 (0.53) ALDH1A1CA12CA1CA2CA4
SCHEMBL417312 0.90 ALDH1A1 (0.53) ALDH1A1CA12CA1CA2CA4
SCHEMBL10582055 0.87 MEN1 (0.52) ALDH1A1CA12CA1CA2CA4
SCHEMBL1830737 0.87 ALDH1A1 (0.37) ALDH1A1CA12CA1CA2CA4
SCHEMBL9509397 0.87 ALDH1A1 (0.37) ALDH1A1CA12CA1CA2CA4
SCHEMBL1774061 0.87 ALDH1A1 (0.38) ALDH1A1CA12CA1CA2CA4

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 1119 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
EP-4734213-A1 ELECTROLYTE FOR LITHIUM-SULFUR BATTERY LG Energy Solution, Ltd. (KR) 2026-04-29 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-20250236569-A1 Lead-free Ballistic Modifier for Rocket Motor Propellants USA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2025-07-24 US claimed
US-20250237601-A1 TRANSPORT AND DETECTION OF EXPLOSIVE SAMPLES ALTI LLC 2025-07-24 US claimed
CN-119381546-A Preparation method and application of in-situ cured polymer electrolyte for lithium-sulfur battery 中南大学 2025-01-28 CN claimed
US-20250011476-A1 ARTICLES COMPRISING CROSSLINKED POLYMER NETWORK COMPRISING THIOETHER CROSSLINKS AND PROCESS OF MAKING AND USING SAME US GOV AIR FORCE (US) 2025-01-09 US claimed
CN-119244398-A Solid-liquid rocket engine grain embedded with metal wire and application thereof 北京航空航天大学 2025-01-03 CN claimed
EP-3969432-B1 PROPELLANT POWDER GRAIN COMPRISING AT LEAST PARTIALLY OBTURATED CHANNELS EURENCO FRANCE SAS (FR) 2024-10-23 EP claimed
US-4014719-A NITRAMINES AND NITRATES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1977-03-29 US claimed
US-4002514-A DOUBLE BASE; NITRAMINE OXIDIZER; TRIAMINOGUANIDINIUM-AZIDE OR -HYDRAZINIUM DIAZIDE THE DOW CHEMICAL COMPANY (US) 1977-01-11 US claimed
US-3996080-A LEAD AND TIN OXIDES IN NITRAMINE PROPELLANTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-12-07 US claimed
US-3979236-A Anti-erosive, solid rocket double-base propellant compositions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-09-07 US claimed
US-3977922-A NITRO COMPOUNDS IN THERMOSETTING RESINS NIPPON OILS AND FATS COMPANY LIMITED (JA) 1976-08-31 US claimed
US-3971681-A Composite double base propellant with triaminoguanidinium azide THE DOW CHEMICAL COMPANY (US) 1976-07-27 US claimed
US-3967989-A High energy propellant compositions including vinyl decaborane-polyester copolymer binder ROHM AND HAAS COMPANY (US) 1976-07-06 US claimed
US-3956890-A Solid propellant binder and propellant BASF WYANDOTTE CORPORATION (US) 1976-05-18 US claimed
US-3957549-A PETRIN ACRYLATE, DINITROPROPYL ACRYLATE, ACRYLIC ACID THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-05-18 US claimed
US-3951704-A SMOKELESS, LEAD STANNATE TOLUENE DIISOCYANATE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-04-20 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 ALDH1A1 4406/4885CA12 2711/4885CA1 976/4885

“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.