SCHEMBL8769203

SCHEMBL8769203

C=CCOC(=O)NCCCC

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.63
TSHR P16473 1/20 0.51
EPHX1 P07099 1/20 0.48
ALOX15 P16050 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46

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
SCHEMBL29940 0.95 ACHE (0.56) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL14328774 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL10349440 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL27357894 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL8769221 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL6332081 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL8769636 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL6332791 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL8769159 0.93 EPHX1 (0.59) ACHETSHREPHX1ZDHHC20ZDHHC2
SCHEMBL4458941 0.89 ACHE (0.47) ACHETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022178592-A1 SOLID PHASE SYNTHESIS OF GLUTAMATE-UREA-LYSINE DERIVED (GUL DERIVED) PROSTATE-SPECIFIC MEMBRANE ANTIGEN (PSMA) TARGETING CONJUGATES AND THEIR USE AS PRECURSORS FOR THERAPEUTIC AND / OR DIAGNOSTIC AGENTS Telix International Pty Ltd (AU) 2022-09-01 WO disclosed
US-20170306381-A1 CELL LINES ALLOZYNE, INC. 2017-10-26 US disclosed
US-9732367-B2 Cell lines MEDIMMUNE LIMITED (GB) 2017-08-15 US disclosed
CN-102197023-B Compounds for the treatment of ophthalmic diseases and disorders ACUCELA INC. (US) 2015-12-16 CN disclosed
US-20150259721-A1 CELL LINES ALLOZYNE, INC. 2015-09-17 US disclosed
US-8404650-B2 Methods of treating cancer with doxazolidine and prodrugs thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2013-03-26 US disclosed
US-8101751-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2012-01-24 US disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20110135618-A1 METHODS OF TREATING CANCER WITH DOXAZOLIDINE AND PRODRUGS THEREOF THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2011-06-09 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
US-7605134-B2 Pesticides MERIAL LIMITED (US) 2009-10-20 US disclosed
US-7605134-B2 Pesticides MERIAL LIMITED (US) 2009-10-20 US disclosed
EP-1421094-B1 4\"-DEOXY-4\"-(S)-AMINO AVERMECTIN DERIVATIVES MERIAL LTD (GB) 2008-10-15 EP disclosed
US-7407952-B2 Reverse-turn mimetics and compositions and methods related thereto MYRIAD GENETICS, INC. (US) 2008-08-05 US disclosed
EP-0579102-B1 Liquid chromatography stationary phases with reduced silanol interactions WATERS INVESTMENTS LTD (US) 1997-09-17 EP disclosed
US-5374755-A Silica substrate with silanol surface groups blocked by (substituted)dialkylcarbamates MILLIPORE CORPORATION (US) 1994-12-20 US disclosed
EP-0579102-A1 Liquid chromatography stationary phases with reduced silanol interactions WATERS INVESTMENTS LIMITED (US) 1994-01-19 EP disclosed
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 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 (4 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-20150259721-A1 CELL LINES AARS1, LARS1, IARS1 ACHE 4880/4885TSHR 563/4885EPHX1 4635/4885
US-20110135618-A1 METHODS OF TREATING CANCER WITH DOXAZOLIDINE AND PRODRUGS THEREOF DNPEP, PEPD, PREP ACHE 448/4885TSHR 3888/4885EPHX1 348/4885
US-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 ACHE 1324/4885TSHR 1567/4885EPHX1 1924/4885
US-20170306381-A1 CELL LINES AARS1, LARS1, IARS1 ACHE 4880/4885TSHR 563/4885EPHX1 4635/4885

“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.