SCHEMBL3103536

SCHEMBL3103536

COc1cc(Cl)c([N+](=O)[O-])cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
ALDH1A1 P00352 5/20 0.58
MAPT P10636 3/20 0.58
KDM4E B2RXH2 2/20 0.58
CYP3A4 P08684 2/20 0.58
ALOX15 P16050 1/20 0.58
PRKDC P78527 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 2/20 0.50
MAPK1 P28482 2/20 0.47
TSHR P16473 1/20 0.47
RAF1 P04049 1/20 0.46
HPGD P15428 1/20 0.46
GFER P55789 1/20 0.46
PAX8 Q06710 1/20 0.46
BLM P54132 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MERTK Q12866 1/20 0.45

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
SCHEMBL10814747 0.90 ALDH1A1 (0.51) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL8536622 0.90 MERTK (0.51) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL30435204 0.90 MERTK (0.51) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL2874199 0.90 LMNA (0.50) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL2840001 0.87 ALDH1A1 (0.49) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL4132806 0.87 LMNA (0.48) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL310130 0.86 LMNA (0.54) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL31188768 0.86 LMNA (0.54) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL9730053 0.85 ALDH1A1 (0.47) LMNAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL2373598 0.85 ALDH1A1 (0.57) LMNAALDH1A1MAPTKDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102344382-A Method for preparing 2,5-dimethoxy-4-chloroaniline by hydrogenation reduction HEBEI HUA CHEM DYE CHEMICAL CO LTD 2012-02-08 CN claimed
CN-102344380-A Method for preparing 2,5-dimethoxy-4-chloroaniline by using liquid-phase catalytic hydrogenation method JIANGSU LIDANING CHEMICAL CO LTD 2012-02-08 CN claimed
US-20220162172-A1 QUINAZOLINONE COMPOUNDS CEREPEUT, INC. 2022-05-26 US disclosed
CN-107325002-B Method for synthesizing aryl halide by taking aryl carboxylic acid as raw material 南昌大学 2020-03-27 CN disclosed
CN-107325002-A A kind of synthetic method using aryl carboxylic acid as the aryl halide of raw material 南昌大学 2017-11-07 CN disclosed
CN-105949069-A Method for continuous hydrogenation production of 4-chloro-2,5-dimethoxyaniline 济南和润化工科技有限公司 2016-09-21 CN disclosed
CN-205556513-U Continuous hydrogenation ware of organic intermediate 彩客科技(北京)有限公司 2016-09-07 CN disclosed
CN-105566112-A Continuous hydrogenation reaction method of organic intermediates and reactor thereof TSAKER TECH (BEIJING) CO LTD 2016-05-11 CN disclosed
US-8999988-B2 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2015-04-07 US disclosed
US-8999988-B2 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2015-04-07 US disclosed
CN-103265441-B Preparation method of 2,5-dimethoxyl-4-chloroaniline XIANGSHUI HENRYDA TECH CHEMICAL CO LTD 2014-06-11 CN disclosed
WO-1997044334-A2 NOVEL PIPERAZINE OR HOMOPIPERAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND A PROCESS FOR THEIR PREPARATION EGIS Gyógyszergyár Rt. (HU) 1997-11-27 WO disclosed
EP-0122533-B1 COLOUR-PHOTOGRAPHIC RECORDING MATERIAL CONTAINING A COLOUR COUPLER Agfa-Gevaert AG (DE) 1989-01-25 EP disclosed
US-4714700-A TRANQUILIZERS, ANXIOLYTIC AGENTS CHOAY S.A. (FR) 1987-12-22 US disclosed
US-4618459-A INTERMEDIATES FOR BENZENESULFONAMIDE DERIVATIVES; ANTIDEPRESSANTS CHOAY S.A. (FR) 1986-10-21 US disclosed
US-4529691-A Non-diffusible yellow coupler AGFA-GEVAERT AG (DE) 1985-07-16 US disclosed
EP-0122533-A2 Colour-photographic recording material containing a colour coupler Agfa-Gevaert AG (DE) 1984-10-24 EP disclosed
US-4457875-A ANTIDEPRESSANTS, TRANQUILIZERS CHOAY S.A. (FR) 1984-07-03 US disclosed
EP-0039440-B1 MEDICINES CONTAINING SUBSTITUTED BENZOTHIAZOL-2-(3H)-ONES Dr. Karl Thomae GmbH (DE) 1983-06-22 EP disclosed
EP-0039440-A1 Medicines containing substituted benzothiazol-2-(3H)-ones Dr. Karl Thomae GmbH (DE) 1981-11-11 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-20220162172-A1 QUINAZOLINONE COMPOUNDS NDUFAB1, NDUFV1, NDUFV2 LMNA 927/4885ALDH1A1 1693/4885MAPT 877/4885

“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.