SCHEMBL948372

SCHEMBL948372

c1ccc(CN2CCOCCOCCOCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.68
HRH3 Q9Y5N1 2/20 0.68
ALDH1A1 P00352 4/20 0.63
HTT P42858 2/20 0.63
KDM4E B2RXH2 1/20 0.63
HPGD P15428 1/20 0.63
NCF1 P14598 1/20 0.61
DRD4 P21917 1/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
TSHR P16473 1/20 0.59
CYP2A13 Q16696 2/20 0.59
POLB P06746 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
KCNJ1 P48048 1/20 0.57
MC4R P32245 1/20 0.57

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
SCHEMBL18065638 1.00 SIGMAR1 (0.68) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL896379 1.00 SIGMAR1 (0.68) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL102338 0.98 SIGMAR1 (0.71) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL6200777 0.98 SIGMAR1 (0.71) SIGMAR1HRH3ALDH1A1HTTKDM4E
Water SCHEMBL1702298 0.96 SIGMAR1 (0.68) SIGMAR1HRH3ALDH1A1HTTKDM4E
Hydrochloric Acid SCHEMBL6261135 0.96 SIGMAR1 (0.68) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL28158277 0.96 SIGMAR1 (0.68) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL6384833 0.94 HRH3 (0.61) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL18309364 0.94 HRH3 (0.61) SIGMAR1HRH3ALDH1A1HTTKDM4E
SCHEMBL24200050 0.93 HRH3 (0.62) SIGMAR1HRH3ALDH1A1HTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9550704-B2 Method for synthesizing radiopharmaceuticals using a cartridge FUTURECHEM CO., LTD. (KR) 2017-01-24 US claimed
US-20150232392-A1 METHOD FOR SYNTHESIZING RADIOPHARMACEUTICALS USING A CARTRIDGE FUTURECHEM CO., LTD. (KR) 2015-08-20 US claimed
US-8641903-B2 Method for the preparation of reactive [18] F fluoride TRASIS S.A. (BE) 2014-02-04 US claimed
EP-2115177-B1 METHOD FOR THE ELUTION OF 18F FLUORIDE TRAPPED ON AN ANION-EXCHANGE PHASE IN A FORM SUITABLE FOR EFFICIENT RADIOLABELING WITHOUT ANY EVAPORATION STEP TRASIS S A (BE) 2011-05-11 EP claimed
US-20110006011-A1 METHOD FOR THE ELUTION OF 18F FLUORIDE TRAPPED ON AN ANION-EXCHANGE PHASE IN A FORM SUITABLE FOR EFFICIENT RADIOLABELING WITHOUT ANY EVAPORATION STEP TRASIS S.A. (BE) 2011-01-13 US claimed
US-20100243972-A1 METHOD FOR THE PREPARATION OF REACTIVE [18] F FLUORIDE TRASIS S.A. (BE) 2010-09-30 US claimed
WO-2026102309-A1 SELECTIVE RADIOTRACERS AND METHODS OF USE LUTROO IMAGING, LLC (US) 2026-05-15 WO disclosed
US-20250352676-A1 N-Cyclopropyl-1-(4-(4-(Fluoro-18f)Phenyl)Pyrimidin-5-Yl)-N-Methylpiperidine- 4-Carboxamide and Uses in PET Imaging UNIV EMORY (US) 2025-11-20 US disclosed
WO-2024035925-A2 N-CYCLOPROPYL-1-(4-(4-(FLUORO-18F)PHENYL)PYRIMIDIN-5-YL)-N-METHYLPIPERIDINE-4-CARBOXAMIDE AND USES IN PET IMAGING EMORY UNIVERSITY (US) 2024-02-15 WO disclosed
US-20230158178-A1 Radionuclide Tracers of 1-Amino-3,4-Difluorocyclopentane-1-Carboxylic Acid, Derivatives, and Uses Thereof UNIV EMORY (US) 2023-05-25 US disclosed
US-20220306663-A1 Metal Tricarbonyl Complexes Comprising Substituted Iminodiactic Acid Ligands and Uses as Radioisotope Tracers UNIV EMORY (US) 2022-09-29 US disclosed
US-11384106-B2 Metal tricarbonyl complexes comprising substituted iminodiactic acid ligands and uses as radioisotope tracers EMORY UNIVERSITY (US) 2022-07-12 US disclosed
CN-107847617-B Metal tricarbonyl complexes containing substituted iminodiacetic acid ligands and their use as radiotracers 爱默蕾大学 2021-08-31 CN disclosed
US-20070190041-A1 Novel benzothiazepine and bensothiepine compounds ASHAI KASEI PHARAMA CORPORATION (JP) 2007-08-16 US disclosed
US-20070190041-A1 Novel benzothiazepine and bensothiepine compounds ASHAI KASEI PHARAMA CORPORATION (JP) 2007-08-16 US disclosed
US-4734376-A SELECTIVE EXTRACTION AND COLORMETRIC DETERMINATION THE PRESIDENT & TRUSTEES OF THE MIAMI UNIVERSITY (US) 1988-03-29 US disclosed
US-4659815-A Chromogenic aza-12-crown-4 ethers and method of using same for the detection of lithium THE PRESIDENT AND TRUSTEES OF THE MIAMI UNIVERSITY (US) 1987-04-21 US disclosed
EP-0079920-B1 NEW AZA-CROWN-ETHERS AND THEIR USE BORREGAARD INDUSTRIES LIMITED (NO) 1986-10-15 EP disclosed
EP-0079920-A1 NEW AZA-CROWN-ETHERS AND THEIR USE. BORREGAARD IND (NO) 1983-06-01 EP disclosed
WO-1982004253-A1 NEW AZA-CROWN-ETHERS AND THEIR USE DALE JOHANNES 1982-12-09 WO 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 (5 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-20150232392-A1 METHOD FOR SYNTHESIZING RADIOPHARMACEUTICALS USING A CARTRIDGE ADCYAP1R1, PAICS, SSTR5 SIGMAR1 1612/4885HRH3 1134/4885ALDH1A1 2900/4885
US-20220306663-A1 Metal Tricarbonyl Complexes Comprising Substituted Iminodiactic Acid Ligands and Uses as Radioisotope Tracers SLC16A8, S100A8, FGF23 SIGMAR1 2627/4885HRH3 1668/4885ALDH1A1 1595/4885
US-20230158178-A1 Radionuclide Tracers of 1-Amino-3,4-Difluorocyclopentane-1-Carboxylic Acid, Derivatives, and Uses Thereof AFF1, METTL3, VHL SIGMAR1 1249/4885HRH3 2475/4885ALDH1A1 243/4885
US-11384106-B2 Metal tricarbonyl complexes comprising substituted iminodiactic acid ligands and uses as radioisotope tracers SLC16A8, S100A8, FGF23 SIGMAR1 2627/4885HRH3 1668/4885ALDH1A1 1595/4885
US-20070190041-A1 Novel benzothiazepine and bensothiepine compounds SLC10A1, GOT1, CES1 SIGMAR1 161/4885HRH3 404/4885ALDH1A1 680/4885

“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.