SCHEMBL306161

SCHEMBL306161

COC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.81

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.81
KMT2A Q03164 3/20 0.78
MEN1 O00255 2/20 0.78
MAPK1 P28482 1/20 0.62
CES1 P23141 1/20 0.61
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
TDP1 Q9NUW8 2/20 0.59
TSHR P16473 1/20 0.57
ALDH1A1 P00352 1/20 0.57
PKM P14618 1/20 0.56
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
HTT P42858 1/20 0.54
PTPN2 P17706 1/20 0.54
PTPN1 P18031 1/20 0.54

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
Iodide SCHEMBL22235392 0.98 POLB (0.78) POLBKMT2AMEN1MAPK1CES1
SCHEMBL3021443 0.94 POLB (0.73) POLBKMT2AMEN1MAPK1CES1
SCHEMBL4236814 0.94 POLB (0.73) POLBKMT2AMEN1MAPK1CES1
SCHEMBL27396578 0.91 POLB (0.79) POLBKMT2AMEN1MAPK1CES1
Sulfamide SCHEMBL27805329 0.91 POLB (0.79) POLBKMT2AMEN1MAPK1CES1
SCHEMBL31504041 0.91 POLB (0.69) POLBKMT2AMEN1MAPK1CES1
4-Nitrobenzoic Acid SCHEMBL27562391 0.91 TDP1 (0.70) POLBKMT2AMEN1MAPK1CES1
SCHEMBL12973292 0.90 POLB (0.68) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL14659792 0.90 POLB (0.68) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL7450958 0.90 POLB (0.77) POLBKMT2AMEN1MAPK1CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010746-A Method for preparing aromatic amide by heterogeneous reductive amidation of nitroaromatic hydrocarbon 中国科学院大连化学物理研究所 2026-05-12 CN claimed
CN-117160452-B Supported iridium-indium bimetallic catalyst for aromatic nitro reduction methylation and preparation method and application thereof 浙江大学衢州研究院 2025-04-25 CN claimed
CN-119657225-A Cu-POM catalyst and preparation method and application thereof 中国药科大学 2025-03-21 CN claimed
WO-2024182515-A1 AGENTS FOR REPELLING, KNOCKING DOWN, AND/OR KILLING BLOOD-SUCKING ARTHROPODS AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2024-09-06 WO claimed
US-20240292836-A1 AGENTS FOR REPELLING, KNOCKING DOWN, AND/OR KILLING BLOOD-SUCKING ARTHROPODS AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE 2024-09-05 US claimed
CN-118388327-A Method for preparing aromatic aldehyde compound by visible light catalysis 大连理工大学 2024-07-26 CN claimed
CN-113817000-B Ferrocene-triazole Schiff base derivative and preparation method thereof 哈尔滨理工大学 2024-07-05 CN claimed
CN-118221543-A Method for preparing 4-aminobenzamide compound by micro-channel reactor 常州永和精细化学有限公司 2024-06-21 CN claimed
CN-117160452-A Supported iridium-indium bimetallic catalyst for aromatic nitro reduction methylation and preparation method and application thereof 浙江大学衢州研究院 2023-12-05 CN claimed
CN-115368243-B Gradient oxygen doped MoS 2 Application in catalyzing C-N coupling reaction 江苏科技大学 2023-11-21 CN claimed
EP-0233288-A1 ACARICIDE EARTH CHEMICAL CO., LTD. (JP) 1987-08-26 EP claimed
US-4601966-A Dry, electrographic developer compositions containing polyester-amide toner particles EASTMAN KODAK COMPANY (US) 1986-07-22 US claimed
EP-0170280-A1 Novel intermediates and process for the preparation of 3-acylamino-1-hydroxy-2-azetidinones E.R. Squibb & Sons, Inc. (US) 1986-02-05 EP claimed
US-4397763-A TITANIUM-BASED PHILLIPS PETROLEUM COMPANY (US) 1983-08-09 US claimed
US-4330648-A MIXTURE OF TITANIUM HALIDE, MAGNESIUM OR MANGANOUS CHLORIDE DIHYDROCARBYLALUMINUM HALIDE OR HYDRIDE AND AN ETHER-ALCOHOL PHILLIPS PETROLEUM COMPANY (US) 1982-05-18 US claimed
US-4312784-A TITANIUM HALIDE, LEWIS BASE, MAGNESIUM OR MANGANOUS CHLORIDE, UNSATURATED HYDROCARBON AND TRIHYDROCARBYLALUMNIUM PHILLIPS PETROLEUM CO. (US) 1982-01-26 US claimed
US-4242480-A TWO OR THREE COMPONENT SYSTEM COMPRISING A TITANIUM HALIDE, LEWIS BASE, MAGNESIUM OR MANGANESE CHLORIDE, UNSATURATED HYDROCARBON, ORGANOALUMINUM COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1980-12-30 US claimed
US-4234710-A TITANIUM HALIDE, MAGNESIUM OR MANGANESE HALIDE, ORGANOALUMINUM, LEWIS BASE, DIORGANOALUMINUM HALIDE PHILLIPS PETROLEUM COMPANY (US) 1980-11-18 US claimed
EP-0002522-A1 Process for polymerizing butene-1 PHILLIPS PETROLEUM COMPANY (US) 1979-06-27 EP claimed
EP-0002521-A1 Titanium-magnesium/manganese-aluminum catalyst and process for olefin polymerization PHILLIPS PETROLEUM COMPANY (US) 1979-06-27 EP 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-20240292836-A1 AGENTS FOR REPELLING, KNOCKING DOWN, AND/OR KILLING BLOOD-SUCKING ARTHROPODS AND USES THEREOF L3MBTL4, L3MBTL3, L3MBTL1 POLB 1747/4885KMT2A 404/4885MEN1 2047/4885

“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.