SCHEMBL3451789

SCHEMBL3451789

Oc1ccc(C(O)(O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.55
ESR2 Q92731 10/20 0.55
CYP3A4 P08684 4/20 0.55
HSD17B10 Q99714 3/20 0.55
LMNA P02545 2/20 0.55
TYR P14679 2/20 0.55
HPGD P15428 2/20 0.55
AR P10275 1/20 0.55
TSHR P16473 1/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A4 P31645 1/20 0.55
HTR6 P50406 1/20 0.55
ESRRG P62508 1/20 0.55
SLC6A3 Q01959 1/20 0.55
ALDH1A1 P00352 3/20 0.53
ALOX15 P16050 3/20 0.53
CA3 P07451 2/20 0.53
HIF1A Q16665 2/20 0.53
CA14 Q9ULX7 2/20 0.53
KDM4E B2RXH2 1/20 0.53

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
SCHEMBL3793827 0.80 ESR1 (0.55) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL11369231 0.80 ESR1 (0.55) ESR1ESR2CYP3A4HSD17B10LMNA
Phenol SCHEMBL7161116 0.79 CA12 (0.61) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL237273 0.76 LMNA (0.67) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL6036607 0.75 ESR1 (0.65) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL13917765 0.75 ESR1 (0.65) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL20673138 0.75 ESR1 (0.65) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL548276 0.75 ESR1 (0.65) ESR1ESR2CYP3A4HSD17B10LMNA
SCHEMBL9775370 0.73 ESR1 (0.55) ESR1ESR2CYP3A4HSD17B10LMNA
Hydroquinone SCHEMBL460669 0.73 ALOX15 (1.00) ESR1ESR2CYP3A4HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112480843-B Adhesive and preparation method thereof 浙江下沙荣成包装有限公司 2022-06-10 CN claimed
CN-109851988-B High-strength rubber plug system capable of being stored for long time at room temperature and preparation method thereof 西安石油大学 2021-10-29 CN claimed
CN-111777953-B Thread locking anaerobic adhesive and preparation method thereof 黑龙江省科学院石油化学研究院 2021-10-29 CN claimed
CN-113549444-A Trace element slow-release tracing proppant and preparation method thereof 山东谊星新材料有限公司 2021-10-26 CN claimed
CN-109912945-B High-molecular-weight polylactic acid material and preparation method thereof 江苏科技大学 2021-04-30 CN claimed
CN-112480843-A Adhesive and preparation method thereof 浙江下沙荣成包装有限公司 2021-03-12 CN claimed
CN-110790876-A Thermoplastic phenolic resin with low content of bisphenol compounds, and preparation method and application thereof 西安交通大学 2020-02-14 CN claimed
CN-110591615-A Preparation method of water-resistant high-viscosity biomass wallpaper adhesive 李文凤 2019-12-20 CN claimed
US-20170233522-A1 PHENOLIC EPOXY COMPOUNDS EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2017-08-17 US claimed
US-20170233357-A1 PHENOLIC EPOXY COMPOUNDS EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2017-08-17 US claimed
CN-104152086-A Modified acrylate high temperature-resistant anaerobic adhesive and preparation method thereof INST PETROCHEMISTRY HEILONGJIANG ACADEMY OF SCIENC 2014-11-19 CN claimed
WO-2014126625-A1 MULTI-FUNCTIONAL ACRYLATES EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-08-21 WO claimed
WO-2014126626-A1 PHENOLIC EPOXY COMPOUNDS EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-08-21 WO claimed
CN-103554395-A Preparation method of aryl-containing boron thermoplastic phenolic resin UNIV XI AN JIAOTONG 2014-02-05 CN claimed
CN-103289033-A Aryl boron-containing phenolic resin and preparation method thereof UNIV XI AN JIAOTONG 2013-09-11 CN claimed
CN-103194158-A High-temperature-resistant anaerobic borosilicate resin hybrid acrylate adhesive and preparation method thereof INST PETROCHEMISTRY HEILONGJIANG ACADEMY OF SCIENCE 2013-07-10 CN claimed
CN-102153999-B Profile modification agent for amphion jelly UNIV XI AN SHIYOU 2012-11-21 CN claimed
CN-102153999-A Profile modification agent for amphion jelly UNIV XIAN SHIYOU 2011-08-17 CN claimed
CN-101497769-A Inorganic / organic hybridized high temperature resistant anaerobic type screw thread locking sealing adhesive and preparation thereof INST OF PETROCHEMISTRY OF HEIL (CN) 2009-08-05 CN claimed
US-5597876-A CURING AGENT PROVIDES BETTER MECHANICAL PROPERTIES AT HIGH TEMPERATURE SHELL OIL COMPANY (US) 1997-01-28 US claimed

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-20170233522-A1 PHENOLIC EPOXY COMPOUNDS ESR1, PTGES, COMT ESR1 1/4885ESR2 7/4885CYP3A4 312/4885
US-20170233357-A1 PHENOLIC EPOXY COMPOUNDS COMT, ESR1, EED ESR1 2/4885ESR2 17/4885CYP3A4 281/4885

“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.