SCHEMBL718255

SCHEMBL718255

O=[N+]([O-])c1cc2c(cc1[N+](=O)[O-])OCO2

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.74
MEN1 O00255 5/20 0.74
KMT2A Q03164 5/20 0.74
POLB P06746 3/20 0.74
L3MBTL1 Q9Y468 2/20 0.74
MCL1 Q07820 1/20 0.74
SRC P12931 1/20 0.59
TXNRD1 Q16881 1/20 0.58
TXNRD3 Q86VQ6 1/20 0.58
TXNRD2 Q9NNW7 1/20 0.58
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 3/20 0.53
GAA P10253 3/20 0.53
TDP1 Q9NUW8 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
APAF1 O14727 1/20 0.49

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
SCHEMBL9471765 0.87 MAPT (0.65) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL9471773 0.87 MAPT (0.65) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL11177694 0.87 SRC (0.60) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL1625765 0.86 MAPT (0.74) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL123842 0.86 MAPT (0.62) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL4126863 0.86 MAPT (0.62) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL608096 0.86 MAPT (0.62) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL20505550 0.86 MAPT (0.68) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL789918 0.86 MAPT (0.62) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL229622 0.86 MAPT (0.62) MAPTMEN1KMT2APOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5015769-A Hair dyes formed by reaction of an alcohol with a phenol in the presence of a strong base for etherification followed by amination L'OREAL (FR) 1991-05-14 US claimed
CN-118401531-A Benzimidazole compound and medical application thereof 中国科学院上海药物研究所 2024-07-26 CN disclosed
WO-2023131333-A1 BENZIMIDAZOLE COMPOUND AND MEDICAL USE THEREOF 中国科学院上海药物研究所 2023-07-13 WO disclosed
US-20230192687-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2023-06-22 US disclosed
US-11560377-B2 Fused amino pyridine as HSP90 inhibitors Guris, Inc. (US) 2023-01-24 US disclosed
US-20220112206-A1 HETEROCYCLIC LSF INHIBITORS AND THEIR USES TRUSTEES OF BOSTON UNIVERSITY (US) 2022-04-14 US disclosed
US-11242353-B2 Heterocyclic LSF inhibitors and their uses TRUSTEES OF BOSTON UNIVERSITY (US) 2022-02-08 US disclosed
US-11242353-B2 Heterocyclic LSF inhibitors and their uses TRUSTEES OF BOSTON UNIVERSITY (US) 2022-02-08 US disclosed
US-20210292317-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2021-09-23 US disclosed
WO-2021150835-A1 HETEROCYCLIC LSF INHIBITORS AND THEIR USES TRUSTEES OF BOSTON UNIVERSITY (US) 2021-07-29 WO disclosed
US-5631373-A NERVOUS SYSTEM DISORDERS STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON, EUGENE OREGON (US) 1997-05-20 US disclosed
EP-0732942-A1 ALKYL, AZIDO, ALKOXY, AND FLUORO-SUBSTITUTED AND FUSED QUINOXALINEDIONES AND THE USE THEREOF AS GLYCINE RECEPTOR ANTAGONISTS ACEA PHARMACEUTICALS, INC. (US) 1996-09-25 EP disclosed
WO-1995012417-A1 ALKYL, AZIDO, ALKOXY, AND FLUORO-SUBSTITUTED AND FUSED QUINOXALINEDIONES AND THE USE THEREOF AS GLYCINE RECEPTOR ANTAGONISTS ACEA PHARMACEUTICALS, INC. (US) 1995-05-11 WO disclosed
US-5015769-A Hair dyes formed by reaction of an alcohol with a phenol in the presence of a strong base for etherification followed by amination L'OREAL (FR) 1991-05-14 US disclosed
US-4904276-A Nitroaminophenols, the process for preparation thereof and their use in dyeing keratinous fibres, and new intermediate nitroaminobenzenes and their use in dyeing keratinous fibres L'OREAL (FR) 1990-02-27 US disclosed
US-4865617-A Dyeing compositions for keratinous fibres, especially for human hair, containing oxidation dye precursors and heterocyclic couplers L'OREAL (FR) 1989-09-12 US disclosed
US-4749379-A HAIR DYES L'OREAL (FR) 1988-06-07 US disclosed
US-4740622-A 3-amino-4-nitrophenols, the process for preparation thereof and their use in dyeing keratinous fibres, and new intermediate 4,5-dinitrophenols L'OREAL (FR) 1988-04-26 US disclosed
US-4216320-A Quinoxaline bleach catalysts CIBA-GEIGY AG (CH) 1980-08-05 US disclosed
US-4145217-A DYE BLEACH CATALYST CIBA-GEIGY AG (CH) 1979-03-20 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 (5 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-11242353-B2 Heterocyclic LSF inhibitors and their uses PCLAF, FLI1, GTF2F1 MAPT 4042/4885MEN1 690/4885KMT2A 2008/4885
US-20230192687-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P MAPT 215/4885MEN1 4305/4885KMT2A 3163/4885
US-20210292317-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P MAPT 215/4885MEN1 4305/4885KMT2A 3163/4885
US-11560377-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P MAPT 215/4885MEN1 4305/4885KMT2A 3163/4885
US-20220112206-A1 HETEROCYCLIC LSF INHIBITORS AND THEIR USES PCLAF, FLI1, GTF2F1 MAPT 4042/4885MEN1 690/4885KMT2A 2008/4885

“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.