SCHEMBL564410

SCHEMBL564410

CC(C)(N)Cc1ccc(O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.67
BLM P54132 2/20 0.62
SLC6A2 P23975 4/20 0.61
HTR2A P28223 1/20 0.61
SLC6A4 P31645 1/20 0.61
HRH1 P35367 1/20 0.61
HTR2B P41595 1/20 0.61
CHRNA4 P43681 1/20 0.61
SLC6A3 Q01959 1/20 0.61
TAAR1 Q96RJ0 5/20 0.60
ESR2 Q92731 7/20 0.59
ABAT P80404 1/20 0.48
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTR3A P46098 1/20 0.44
BACE1 P56817 1/20 0.44
L3MBTL1 Q9Y468 1/20 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
Oxalic Acid SCHEMBL9707013 0.90 BLM (0.68) ESR1BLMSLC6A2HTR2ASLC6A4
Acetic Acid SCHEMBL5733361 0.90 BLM (0.68) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL5830710 0.88 ESR1 (0.53) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL25596196 0.82 BLM (0.63) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL25596195 0.82 BLM (0.63) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL9583933 0.80 ESR1 (0.59) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL25596280 0.80 ESR1 (0.59) ESR1BLMSLC6A2HTR2ASLC6A4
SCHEMBL5329248 0.80 ESR1 (0.64) ESR1BLMSLC6A2SLC6A4SLC6A3
SCHEMBL73405 0.80 ESR1 (1.00) ESR1BLMSLC6A2SLC6A4SLC6A3
SCHEMBL228926 0.80 SLC6A2 (0.67) ESR1BLMSLC6A2HTR2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119409579-A Preparation method of lubabarin key intermediate 江苏天和制药股份有限公司 2025-02-11 CN claimed
CN-115611752-A Synthetic refining method of lubabylon intermediate 江苏天和制药有限公司 2023-01-17 CN claimed
CN-105968302-B Material and preparation method thereof is combined for ultralow temperature LNG storage tank storage cold insulation polyurethane coating 江苏长顺高分子材料研究院有限公司 2018-09-04 CN claimed
CN-103748149-B Emulsions and their use in the preparation of foams based on isocyanates 科思创德国股份有限公司 2016-08-31 CN claimed
CN-103748149-A Emulsions and their use in the preparation of foams based on isocyanates BAYER IP GMBH 2014-04-23 CN claimed
CN-101883664-A The liquid resin composition that is used for abrasive article SAINT GOBAIN ABRASIVES INC 2010-11-10 CN claimed
CN-101257974-A Polyisocyanurate rigid foam and process for producing same BASF SE (DE) 2008-09-03 CN claimed
EP-0145164-B1 PROCESS FOR IMPROVING MOISTURE RESISTANCE OR EPOXY RESINS BY ADDITION OF CHROMIUM IONS NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1987-03-04 EP claimed
CN-119463302-A Polypropylene nucleating agent and preparation method and application thereof 中国石油天然气股份有限公司 2025-02-18 CN disclosed
CN-119409579-A Preparation method of lubabarin key intermediate 江苏天和制药股份有限公司 2025-02-11 CN disclosed
US-11970576-B2 Beta-peptido sugar-copolymer NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2024-04-30 US disclosed
CN-115611752-A Synthetic refining method of lubabylon intermediate 江苏天和制药有限公司 2023-01-17 CN disclosed
CN-115611752-A Synthetic refining method of lubabylon intermediate 江苏天和制药有限公司 2023-01-17 CN disclosed
US-20220332892-A1 BETA-PEPTIDO SUGAR-COPOLYMER NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2022-10-20 US disclosed
EP-0014745-B1 CURING AGENT FOR POLYEPOXIDES, CURABLE EPOXY RESIN COMPOSITIONS, HARDENED PRODUCTS THEREFROM AND PROCESS FOR CURING A POLYEPOXIDE DIAMOND SHAMROCK CORPORATION (US) 1983-05-25 EP disclosed
US-4336267-A Heart active compounds and methods of use AKTIEBOLAGET HASSLE (SE) 1982-06-22 US disclosed
US-4244969-A (P-HYDROXYPHENOXY)PROPANOLAMINE DERIVATIVES USEFUL AS B-RECEPTOR STIMULANTS AKTIEBOLAGET HASSLE (SE) 1981-01-13 US disclosed
US-4161542-A 3-(2-/P-HYDROXYPHENYL/-1-METHYLETHYLAMINO)-1-PHENOXY-2-PROPANOL/; AKTIEBOLAGET HASSLE (SE) 1979-07-17 US disclosed
US-4148908-A BRONCHODILATORS MEAD JOHNSON & COMPANY (US) 1979-04-10 US disclosed
US-4055658-A BETA-ADRENERGIC STIMULANTS, BRONCHIAL MEAD JOHNSON & COMPANY (US) 1977-10-25 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-20220332892-A1 BETA-PEPTIDO SUGAR-COPOLYMER PBK, PYGB, PDXK ESR1 3951/4885BLM 2074/4885SLC6A2 2253/4885
US-11970576-B2 Beta-peptido sugar-copolymer PBK, PYGB, PDXK ESR1 3951/4885BLM 2074/4885SLC6A2 2253/4885

“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.