SCHEMBL7439288

SCHEMBL7439288

O=C1OCc2cccc([N+](=O)[O-])c21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.54
S100A4 P26447 2/20 0.50
MAPT P10636 2/20 0.49
RECQL P46063 1/20 0.49
KMT2A Q03164 1/20 0.49
MCL1 Q07820 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
GPR35 Q9HC97 2/20 0.47
PTPRC P08575 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
ERN1 O75460 1/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MITF O75030 1/20 0.41

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
SCHEMBL6214355 0.79 GPR35 (0.48) ACHEMAPTRECQLKMT2AGPR35
SCHEMBL22472306 0.78 TDP1 (0.47) ACHES100A4MAPTRECQLKMT2A
SCHEMBL16701466 0.76 ACHE (0.55) ACHES100A4MAPTRECQLKMT2A
SCHEMBL28381941 0.75 ACHE (0.58) ACHES100A4MAPTRECQLKMT2A
SCHEMBL10571400 0.75 TDP1 (0.43) ACHES100A4MAPTRECQLKMT2A
SCHEMBL30740520 0.74 MAPT (0.66) ACHES100A4MAPTRECQLKMT2A
SCHEMBL3039191 0.73 TDP1 (0.67) ACHES100A4MAPTRECQLKMT2A
SCHEMBL4621603 0.73 ACHE (0.56) ACHES100A4MAPTRECQLKMT2A
SCHEMBL332607 0.71 POLB (0.53) S100A4MAPTRECQLKMT2AMCL1
SCHEMBL10566080 0.70 ACHE (0.53) ACHES100A4MAPTRECQLKMT2A

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
EP-3189059-B1 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ST EUROPEO DI ONCOLOGIA S R L (IT) 2023-02-22 EP disclosed
CN-113773598-A Preparation method of carbon-based composite material 宁波信远炭材料股份有限公司 2021-12-10 CN disclosed
US-10183952-B2 Thienopyrroles as histone demethylase inhibitors ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2019-01-22 US disclosed
US-20170260197-A1 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2017-09-14 US disclosed
EP-3189059-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS Istituto Europeo di Oncologia S.r.l. (IT) 2017-07-12 EP disclosed
WO-2016034946-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2016-03-10 WO disclosed
EP-2993175-A1 Thienopyrroles as histone demethylase inhibitors IEO - Istituto Europeo di Oncologia Srl (IT) 2016-03-09 EP disclosed
WO-1993008185-A1 N-ARYL-N1-AZABICYCLO-UREAS AS 5-HT3 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-04-29 WO disclosed
EP-0166516-B1 NOVEL PHENYL-SUBSITUTED SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-08 EP disclosed
US-4948416-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-08-14 US disclosed
US-4867781-A PRE- AND POSTEMERGENCE HERBICIDES; NONPHYTOTOXIC E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-09-19 US disclosed
US-4842639-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-27 US disclosed
US-4802911-A HERBICIDES, PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-02-07 US disclosed
EP-0107979-B1 NOVEL PHENYL-SUBSTITUTED SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-12 EP disclosed
US-4741761-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-03 US disclosed
US-4620870-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-11-04 US disclosed
US-4586950-A HERBICIDES E. I. DU PONT DE NEMOURS & COMPANY (US) 1986-05-06 US disclosed
EP-0166516-A2 Novel phenyl-subsituted sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-01-02 EP disclosed
EP-0107979-A1 Novel phenyl-substituted sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-05-09 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 (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-10183952-B2 Thienopyrroles as histone demethylase inhibitors KDM1A, KDM1B, KDM3A ACHE 4233/4885S100A4 4690/4885MAPT 3613/4885
US-20170260197-A1 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS KDM1A, KDM1B, KDM3A ACHE 4233/4885S100A4 4690/4885MAPT 3613/4885

“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.