SCHEMBL5320665

SCHEMBL5320665

Nc1ccc(ON=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 8/20 0.50
ALDH1A1 P00352 7/20 0.50
CYP3A4 P08684 3/20 0.50
TSHR P16473 2/20 0.50
MAPK1 P28482 2/20 0.46
MAOA P21397 2/20 0.42
MAPT P10636 7/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.41
NR4A1 P22736 1/20 0.41
TEAD4 Q15561 1/20 0.41
MAOB P27338 1/20 0.41
PARP10 Q53GL7 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 2/20 0.39
GFER P55789 2/20 0.39
POLB P06746 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
Pyridine SCHEMBL27482924 0.84 MEN1 (0.43) TDP1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL27317185 0.74
SCHEMBL27989835 0.74 CA1 (0.43) APP
SCHEMBL9246841 0.74 ACHE (0.48) TDP1ALDH1A1CYP3A4TSHRMAPT
SCHEMBL27856948 0.74 CA2 (0.43) ALDH1A1MAPK1MAOAMAPTMEN1
SCHEMBL27761719 0.74 SOS1 (0.39) ALDH1A1MAOAMEN1KMT2AMAOB
SCHEMBL27516836 0.74 MEN1 (0.43) TDP1ALDH1A1CYP3A4MAPK1MAOA
SCHEMBL17315654 0.74 CA1 (0.58) TDP1ALDH1A1CYP3A4MAPK1MAPT
SCHEMBL8205653 0.74 MEN1 (0.50) TDP1ALDH1A1CYP3A4MAPTMEN1
SCHEMBL306544 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107778255-B A kind of Diarylmiazines HIV-1 reverse transcriptase inhibitor and its preparation method and application 山东大学 2019-10-25 CN claimed
US-5693442-A ELEMENT HAVING OVERCOAT OVERLYING CHARGE GENERATING LAYER COMPRISING DYE AND/OR ORGANIC PIGMENT AND COMPLEX OF INORGANIC OXIDE POLYMER AND CHARGE CARRIER EASTMAN KODAK COMPANY (US) 1997-12-02 US claimed
CN-113121997-B Nitrile-based resin single-component composite material recovered based on nitrile-based resin and preparation method thereof 成都大学 2022-09-30 CN disclosed
CN-113121997-A Nitrile resin single-component composite material based on nitrile resin recovery and preparation method thereof 成都大学 2021-07-16 CN disclosed
CN-105606605-B A kind of Hydroxyphenylalanineurine urine detection reagent box and preparation method 张凤华 2019-09-20 CN disclosed
CN-109280179-A A kind of covalent organic framework material and preparation method thereof and the application in hindered amines synthesis 天罡新材料(廊坊)股份有限公司 2019-01-29 CN disclosed
CN-108059605-A The synthetic method of p-aminophenyl formonitrile HCN 江苏优普生物化学科技股份有限公司 2018-05-22 CN disclosed
CN-104768952-B PI3K inhibitors 山东亨利医药科技有限责任公司 2016-10-19 CN disclosed
US-20070248581-A1 MGRA IS A REDOX REGULATOR OF ANTIBIOTIC SENSITIVITY AND VIRULENCE THE UNIVERSITY OF CHICAGO 2007-10-25 US disclosed
WO-2007090123-A2 MGRA IS A REDOX REGULATOR OF ANTIBIOTIC SENSITIVITY AND VIRULENCE UNIVERSITY OF CHICAGO (US) 2007-08-09 WO disclosed
CN-1182203-C Modified carbon products and amphiphilic ions containing compositions ���Ͽع����޹�˾ 2004-12-29 CN disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
CN-1227585-A Modified carbon products and amphiphilic ions containing compositions CABOT CORP (US) 1999-09-01 CN disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
US-5693442-A ELEMENT HAVING OVERCOAT OVERLYING CHARGE GENERATING LAYER COMPRISING DYE AND/OR ORGANIC PIGMENT AND COMPLEX OF INORGANIC OXIDE POLYMER AND CHARGE CARRIER EASTMAN KODAK COMPANY (US) 1997-12-02 US disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP 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-20070248581-A1 MGRA IS A REDOX REGULATOR OF ANTIBIOTIC SENSITIVITY AND VIRULENCE GFER, GLRX3, PRDX3 TDP1 4706/4885ALDH1A1 3399/4885CYP3A4 2493/4885

“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.