SCHEMBL8091665

SCHEMBL8091665

O=C1c2ccc([N+](=O)[O-])cc2-c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 3/20 0.78
S100A4 P26447 2/20 0.76
BCHE P06276 1/20 0.71
ACHE P22303 1/20 0.71
CES1 P23141 1/20 0.71
HSD17B10 Q99714 3/20 0.62
CYP1A2 P05177 2/20 0.62
HIF1A Q16665 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
ALDH1A1 P00352 2/20 0.62
CYP3A4 P08684 2/20 0.62
CA9 Q16790 3/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA7 P43166 1/20 0.58
MAPT P10636 3/20 0.57
CASP3 P42574 2/20 0.56
CAPN9 O14815 1/20 0.56
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55

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
SCHEMBL8104719 0.96 PTPRC (0.84) PTPRCS100A4BCHEACHECES1
SCHEMBL30375977 0.96 PTPRC (0.84) PTPRCS100A4BCHEACHECES1
SCHEMBL11207794 0.95 PTPRC (0.83) PTPRCS100A4BCHEACHECES1
SCHEMBL2772220 0.95 PTPRC (0.83) PTPRCS100A4BCHEACHECES1
SCHEMBL8668444 0.92 PTPRC (0.93) PTPRCS100A4BCHEACHECES1
SCHEMBL1237207 0.91 PTPRC (0.91) PTPRCS100A4BCHEACHECES1
SCHEMBL30349970 0.91 PTPRC (0.91) PTPRCS100A4BCHEACHECES1
SCHEMBL5156700 0.90 PTPRC (0.89) PTPRCS100A4BCHEACHECES1
SCHEMBL229511 0.88 PTPRC (0.93) PTPRCS100A4BCHEACHECES1
SCHEMBL6940816 0.88 PTPRC (1.00) PTPRCS100A4BCHEACHECES1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655264-B2 Metallocene compounds, and preparation and use thereof for synthesis of poly-alpha-olefins as lubricating base oil APALENE TECHNOLOGY CO., LTD. (HANGZHOU) (CN) 2023-05-23 US disclosed
CN-105330508-B One kind 3 is monosubstituted or 3,6 2 replace fluorene derivative and its preparation method and application 亚培烯科技(杭州)有限公司 2019-04-19 CN disclosed
CN-105384611-B A kind of electron donor of Ziegler-Natta catalyst and preparation method thereof 亚培烯科技(杭州)有限公司 2019-04-19 CN disclosed
CN-105330771-B A kind of metallocene linear-low density polyethylene catalyst and its preparation method and application 亚培烯科技(杭州)有限公司 2018-12-14 CN disclosed
US-20180258112-A1 Metallocene compounds, and preparation and use thereof for synthesis of poly-alpha-olefins as lubricating base oil APALENE TECHNOLOGY CO., LTD. (JIAXING) (CN) 2018-09-13 US disclosed
CN-106146692-A Synthetic lubricant base oil metallocene poly-alpha olefins catalyst and its preparation method and application 苏州亚培克生物科技有限公司 2016-11-23 CN disclosed
CN-106046211-A Metallocene poly-alpha olefin catalyst for synthesizing lubricating oil base oil and preparation method and application thereof 苏州亚培克生物科技有限公司 2016-10-26 CN disclosed
CN-1246415-A Method for producing pattern forming article CCA K K (JP) 2000-03-08 CN disclosed
EP-0974437-A2 Method for producing patterned shaped articles CCA INC. (JP) 2000-01-26 EP disclosed
EP-0114482-B1 A PHOTOSENSITIVE COMPOSITION FOR ELECTROPHOTOGRAPHY MITA INDUSTRIAL CO. LTD. (JP) 1988-09-14 EP disclosed
US-4741981-A Photosensitive material for electrophotography contains organic phosphite compounds RICOH CO., LTD. (JP) 1988-05-03 US disclosed
EP-0100581-B1 PHOTOSENSITIVE MATERIAL FOR ELECTROPHOTOGRAPHY MITA INDUSTRIAL CO. LTD. (JP) 1987-08-26 EP disclosed
US-4574114-A Photosensitive composition for electrophotography having polyvinyl carbazole and silicone oil MITA INDUSTRIAL COMPANY, LTD. (JP) 1986-03-04 US disclosed
US-4521504-A DICHROMATIC IMAGES-CONDUCTIVE SUBSTRATE LAMINATED WITH PHOTOCONDUCTIVE RICOH COMPANY, LTD. (JP) 1985-06-04 US disclosed
US-4469769-A Photosensitive material for electrophotography contains halo-benzoquinone sensitizer MITA INDUSTRIAL CO. LTD. (JP) 1984-09-04 US disclosed
EP-0100581-A2 Photosensitive material for electrophotography MITA INDUSTRIAL CO. LTD. (JP) 1984-02-15 EP disclosed
US-4370398-A Electrostatic copying process RICOH COMPANY, LTD. (JP) 1983-01-25 US disclosed
US-4361638-A AMORPHOUS SILICON AND CARBON BASE MATERIAL DOPED WITH HYDROGEN AND FLUORINE FUJI PHOTO FILM CO., LTD. (JP) 1982-11-30 US disclosed
US-4352876-A CHARGE GENERATION AND CHARGE TRANSPORT LAYERS HITACHI, LTD. (JP) 1982-10-05 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 (2 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-11655264-B2 Metallocene compounds, and preparation and use thereof for synthesis of poly-alpha-olefins as lubricating base oil POLM, POLA1, POLD1 PTPRC 3949/4885S100A4 2707/4885BCHE 2575/4885
US-20180258112-A1 Metallocene compounds, and preparation and use thereof for synthesis of poly-alpha-olefins as lubricating base oil POLM, POLA1, POLD1 PTPRC 3949/4885S100A4 2707/4885BCHE 2575/4885

“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.