SCHEMBL26827

SCHEMBL26827

N#CC(=CC(=O)O)c1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.56
ESR2 Q92731 3/20 0.56
NQO2 P16083 1/20 0.51
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 1/20 0.46
CA2 P00918 3/20 0.45
CA1 P00915 2/20 0.45
CA12 O43570 1/20 0.45
CA3 P07451 1/20 0.45
TYR P14679 1/20 0.45
DRD1 P21728 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
HPGD P15428 2/20 0.44

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
SCHEMBL28093622 1.00 ESR1 (0.56) ESR1ESR2NQO2ALDH1A1MAPT
SCHEMBL28554503 1.00 ESR1 (0.56) ESR1ESR2NQO2ALDH1A1MAPT
SCHEMBL854364 1.00 ESR1 (0.56) ESR1ESR2NQO2ALDH1A1MAPT
Phosphoric Acid SCHEMBL5330100 0.93 ESR1 (0.50) ESR1ESR2NQO2ALDH1A1MAPT
Pyridine SCHEMBL1237058 0.89 ESR1 (0.46) ESR1ESR2NQO2ALDH1A1MAPT
Ether SCHEMBL27951660 0.87 NQO2 (0.45) ESR1ESR2NQO2ALDH1A1MAPT
Coumaric Acid SCHEMBL20261721 0.87 ESR1 (0.62) ESR1ESR2NQO2MAPTKMT2A
SCHEMBL22691970 0.86 TSHR (0.48) ESR1ESR2ALDH1A1KMT2ACA2
Gentisic Acid SCHEMBL28367375 0.85 PTGS2 (0.56) ESR1ESR2NQO2ALDH1A1KMT2A
SCHEMBL670068 0.84 ALDH1A1 (0.46) ALDH1A1MAPTKMT2ACA2CA1

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

Appears in 10935 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025226707-A1 ASSAY AND KIT FOR DETECTING AND QUANTIFYING GLYCOGEN UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2025-10-30 WO claimed
WO-2025226937-A1 DEVICE AND METHOD FOR SINGLE CELL CAPTURE AND ANALYSIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2025-10-30 WO claimed
US-20250231190-A1 ENHANCED FLUORESCENCE SIGNAL THROUGH THE APPLICATION OF AROMATIC ADDITIVES ONTO THE MICROSCOPY SAMPLE FOR STANDARD FLUORESCENCE, FLUORESCENCE MICROSCOPY AND COMBINED FLUORESCENCE MALDI MICROSCOPY/IMAGING THE JOHNS HOPKINS UNIVERSITY 2025-07-17 US claimed
CN-120195391-A Antigen preparation with sensitivity and specificity for allergy detection and preparation method thereof 上海海洋大学 2025-06-24 CN claimed
CN-120084861-A Method for analyzing and identifying intestinal microbial flora of prawns based on mass spectrometry and bacterial library search so as to realize geographical traceability of prawns 上海海洋大学 2025-06-03 CN claimed
CN-119811679-A Neural network-based predictive model construction method for ankylosing spondylitis 江苏省中医院 2025-04-11 CN claimed
CN-119688819-A Detection method of ceftiofur sodium serving as drug metabolism molecule 山东省分析测试中心 2025-03-25 CN claimed
CN-119678039-A Matrix solution, mass analysis method, storage medium, and discrimination method 株式会社岛津制作所 2025-03-21 CN claimed
US-20250067751-A1 PHOTOCLEAVABLE MASS-TAGS FOR MULTIPLEXED MASS SPECTROMETRIC IMAGING OF TISSUES USING BIOMOLECULAR PROBES AMBERGEN INC (US) 2025-02-27 US claimed
CN-113861074-B Preparation method and application of ionic liquid MALDI matrix 中国检验检疫科学研究院 2025-01-24 CN claimed
EP-0764264-A2 ENHANCED RESOLUTION MALDI TOF-MS SAMPLE SURFACE Waters Corporation (US) 1997-03-26 EP claimed
US-5589554-A BASED ON A 2-CYANOACRYLATE THREE BOND CO., LTD. (JP) 1996-12-31 US claimed
US-5580434-A Interface apparatus for capillary electrophoresis to a matrix-assisted-laser-desorption-ionization mass spectrometer HEWLETT-PACKARD COMPANY (US) 1996-12-03 US claimed
WO-1996033797-A1 MATRIX-BEARING TARGETS FOR MALDI MASS SPECTROMETRY AND METHODS OF PRODUCTION THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1996-10-31 WO claimed
EP-0700521-A1 METHOD AND APPARATUS FOR DESORPTION AND IONIZATION OF ANALYTES BAYLOR COLLEGE OF MEDICINE (US) 1996-03-13 EP claimed
WO-1995015001-A2 ENHANCED RESOLUTION MALDI TOF-MS SAMPLE SURFACE WATERS CORPORATION (US) 1995-06-01 WO claimed
WO-1994028418-A1 METHOD AND APPARATUS FOR DESORPTION AND IONIZATION OF ANALYTES BAYLOR COLLEGE OF MEDICINE (US) 1994-12-08 WO claimed
EP-0210449-B1 PROLONGED CHEMILUMINESCENCE MILES INC. (US) 1993-07-28 EP claimed
US-4950588-A DETECTION OF NUCLEIC ACID HYBRIDS, ANTIBODIES ANTIGENS MOLECULAR DIAGNOSTICS, INC. (US) 1990-08-21 US claimed
EP-0210449-A2 Prolonged chemiluminescence MILES INC. (US) 1987-02-04 EP claimed