SCHEMBL57381

SCHEMBL57381

O=[N+]([O-])c1cc([N+](=O)[O-])c2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 1.00
TSHR P16473 1/20 1.00
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
RAB9A P51151 2/20 0.61
ALDH1A1 P00352 7/20 0.60
HPRT1 P00492 1/20 0.56
CASP6 P55212 1/20 0.56
CYP3A4 P08684 1/20 0.55
MAPT P10636 5/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 2/20 0.47
HPGD P15428 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
MPI P34949 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL29475186 1.00 TDP1 (1.00) TDP1TSHRMEN1KMT2ARAB9A
Methane SCHEMBL28603558 0.98 TDP1 (0.96) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL9734226 0.85 TDP1 (0.74) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL29720550 0.82 TDP1 (0.70) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL27573661 0.81 TDP1 (0.68) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL31722809 0.81 TDP1 (0.68) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL8622947 0.80 HPRT1 (0.76) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL28796976 0.80 TDP1 (0.66) TDP1TSHRMEN1KMT2ARAB9A
Trinitrophenol SCHEMBL27908169 0.80 ALDH1A1 (0.69) TDP1TSHRMEN1KMT2ARAB9A
SCHEMBL17599539 0.79 TSHR (0.66) TDP1TSHRMEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113184834-B Nitrogen-doped graphene quantum dot, preparation thereof and application thereof in detecting hydrogen peroxide 浙江理工大学 2022-08-09 CN claimed
CN-113184834-A Nitrogen-doped graphene quantum dot, preparation thereof and application thereof in detecting hydrogen peroxide 浙江理工大学 2021-07-30 CN claimed
CN-106467467-A A kind of method that fixed bed continuous catalytic hydrogenation prepares diaminonaphthalene 南通龙翔化工有限公司 2017-03-01 CN claimed
US-8710502-B2 Thin film transistor and flat panel display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2014-04-29 US claimed
US-7732534-B2 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2010-06-08 US claimed
US-20090140254-A1 THIN FILM TRANSISTOR AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2009-06-04 US claimed
US-7504659-B2 Thin film transistor and flat panel display device including the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2009-03-17 US claimed
US-20080051552-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION 2008-02-28 US claimed
US-20080051519-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2008-02-28 US claimed
US-20060186410-A1 Thin film transistor and flat panel display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2006-08-24 US claimed
US-5663030-A A PHENYL OR NORBORNANE DERIVATIVE AS AN ADDITIVE TO REDUCE HEAT AND ENERGY REQUIRED TO FUSE THE TONER AND TO REDUCE JAMMING OF THE EQUIPMENT XEROX CORPORATION (US) 1997-09-02 US claimed
EP-3915996-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2025-09-10 EP disclosed
US-12161045-B2 Pyrromethene boron complex, light emitting element using same, display device, lighting device, color conversion composition, color conversion film, color conversion substrate, light source unit and display TORAY INDUSTRIES, INC. (JP) 2024-12-03 US disclosed
CN-117940412-A Fluoranthene derivative, light-emitting element, and photoelectric conversion element 东丽先端材料研究开发(中国)有限公司 2024-04-26 CN disclosed
EP-4326036-A2 ORGANIC ELECTROLUMINESCENT ELEMENT UDC Ireland Limited (IE) 2024-02-21 EP disclosed
EP-0282978-A2 Surface acoustic wave convolver with dielectric film of high non-linear effect CANON KABUSHIKI KAISHA (JP) 1988-09-21 EP disclosed
EP-0101741-B1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-05-20 EP disclosed
US-4521793-A Coloring method and color-forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-04 US disclosed
EP-0101741-A1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-03-07 EP disclosed
US-4026944-A TREATING DINITRONAPHTHALENE WITH HYDROGEN, HYDROGENATION CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 US 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-12161045-B2 Pyrromethene boron complex, light emitting element using same, display device, lighting device, color conversion composition, color conversion film, color conversion substrate, light source unit and display RB1, AHR, CRY1 TDP1 1544/4885TSHR 628/4885MEN1 1154/4885

“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.