SCHEMBL967910

SCHEMBL967910

O=[N+]([O-])c1ccc2ccc3c([N+](=O)[O-])ccc4ccc1c2c43

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 3/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HPRT1 P00492 1/20 0.46
CTSB P07858 3/20 0.45
CTSH P09668 1/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
CES1 P23141 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.41
TSHR P16473 4/20 0.40
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL29450698 1.00 TDP1 (0.50) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL1804954 1.00 TDP1 (0.50) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
1-Nitropyrene SCHEMBL29450697 0.92 ALDH1A1 (0.57) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
1-Nitropyrene SCHEMBL339725 0.92 ALDH1A1 (0.57) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL29403406 0.92 HPRT1 (0.49) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL16593674 0.92 HPRT1 (0.49) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
1-Nitropyrene SCHEMBL28378090 0.90 ALDH1A1 (0.55) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL16593473 0.88 TDP1 (0.44) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL4539666 0.88 CTSB (0.59) TDP1ALDH1A1CYP3A4ALOX15HSD17B10
SCHEMBL14298072 0.88 ALDH1A1 (0.42) TDP1ALDH1A1CYP3A4ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025124901-A1 PROCESS FOR PRODUCING PURIFIED CARBON BLACKS WITH REDUCED CONTENT OF OXIDIZED POLYCYCLIC AROMATIC HYDROCARBONS ORION ENGINEERED CARBONS IP GMBH & CO. KG (DE) 2025-06-19 WO claimed
CN-114686215-B Fluorescent material and preparation method and application thereof TCL科技集团股份有限公司 2024-06-14 CN claimed
CN-114686215-A Fluorescent material and preparation method and application thereof TCL科技集团股份有限公司 2022-07-01 CN claimed
CN-113960220-B Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-03-04 CN claimed
CN-113960220-A Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-01-21 CN claimed
US-10808142-B2 Method of preparing graphene quantum dot, hardmask composition including the graphene quantum dot obtained by the method, method of forming patterns using the hardmask composition, and hardmask formed from the hardmask composition SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-10-20 US claimed
US-20190031906-A1 METHOD OF PREPARING GRAPHENE QUANTUM DOT, HARDMASK COMPOSITION INCLUDING THE GRAPHENE QUANTUM DOT OBTAINED BY THE METHOD, METHOD OF FORMING PATTERN USING THE HARDMASK COMPOSITION, AND HARDMASK FORMED FROM THE HARDMASK COMPOSITION SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-01-31 US claimed
US-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS CHIMERIX, INC. 2011-01-20 US claimed
US-7732534-B2 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2010-06-08 US claimed
US-20080051519-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2008-02-28 US claimed
US-20080051552-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION 2008-02-28 US claimed
CN-121674302-B Lactobacillus plantarum, zhong Huang ferment, preparation method and application thereof in improving bone health Hunan Nutrition Tree Biotechnology Co.,Ltd. (CN) 2026-05-26 CN disclosed
EP-4263724-B1 PROCESS FOR PRODUCING CARBON BLACKS WITH REDUCED POLYCYCLIC AROMATIC HYDROCARBON CONTENT UTILIZING SUPERCRITICAL FLUID EXTRACTION ORION ENG CARBONS IP GMBH & CO KG (DE) 2026-04-15 EP disclosed
WO-2025124901-A1 PROCESS FOR PRODUCING PURIFIED CARBON BLACKS WITH REDUCED CONTENT OF OXIDIZED POLYCYCLIC AROMATIC HYDROCARBONS ORION ENGINEERED CARBONS IP GMBH & CO. KG (DE) 2025-06-19 WO disclosed
CN-116072855-B Silicon-carbon negative electrode material and preparation method thereof 中国科学院成都有机化学有限公司 2025-06-17 CN disclosed
WO-2002037990-A2 METHOD AND PRODUCT FOR REMOVING CARCINOGENS FROM TOBACCO SMOKE VECTOR TOBACCO LTD. (BM) 2002-05-16 WO disclosed
EP-0742722-B1 METHOD FOR INCREASING BIOAVAILABILITY OF ORAL PHARMACEUTICAL COMPOSITIONS UNIV CALIFORNIA (US) 2002-04-17 EP disclosed
WO-2001097843-A2 METHODS FOR ENHANCING ANTIBODY-INDUCED CELL LYSIS AND TREATING CANCER UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2001-12-27 WO disclosed
EP-1127579-A2 Method for increasing bioavailability of oral pharmaceutical compositions THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-08-29 EP disclosed
WO-2000003721-A1 IMMUNOSUPPORTIVE DRUG SPARING DIET BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-01-27 WO disclosed

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-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS ACE, CYP27A1, LIPC TDP1 1517/4885ALDH1A1 857/4885CYP3A4 25/4885

“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.