SCHEMBL3173157

SCHEMBL3173157

O=C1NC(=O)C(C2CC(OCc3ccccc3)C2)N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
NAAA Q02083 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSK P43235 1/20 0.38
OPRM1 P35372 2/20 0.38
OPRL1 P41146 2/20 0.38
DPP4 P27487 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
ADORA2B P29275 3/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36

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
SCHEMBL7926231 0.91 EPHX2 (0.39) BCHEACHENAAACTSLCTSB
SCHEMBL12482253 0.75 CTSL (0.51) NAAACTSLCTSBCTSKOPRM1
SCHEMBL20178567 0.75 CTSL (0.51) NAAACTSLCTSBCTSKOPRM1
SCHEMBL26088403 0.71 CTSL (0.42) NAAACTSLCTSBCTSKOPRM1
SCHEMBL8952292 0.71 BCHE (0.43) BCHEACHECTSLCTSBCTSK
SCHEMBL741694 0.70 CTSL (0.50) NAAACTSLCTSBCTSKOPRM1
SCHEMBL15259415 0.70 CTSL (0.50) NAAACTSLCTSBCTSKOPRM1
SCHEMBL741692 0.70 CTSL (0.50) NAAACTSLCTSBCTSKOPRM1
SCHEMBL741693 0.70 CTSL (0.50) NAAACTSLCTSBCTSKOPRM1
SCHEMBL871908 0.69 NPC1 (0.49) BCHENAAACTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3530648-B1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2023-11-08 EP disclosed
EP-3530648-A1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDI-PHYSICS CO., LTD (JP) 2019-08-28 EP disclosed
EP-2128130-B1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2018-10-10 EP disclosed
EP-2646411-B1 PREPARATION OF PET PRECURSOR BLUE EARTH DIAGNOSTICS LTD (GB) 2017-08-16 EP disclosed
EP-2655321-B1 PURIFICATION OF PRECURSOR COMPOUND BY CRYSTALLISATION GE HEALTHCARE LTD (GB) 2017-02-15 EP disclosed
US-9278916-B2 Preparation of pet precursor GE HEALTHCARE LIMITED (GB) 2016-03-08 US disclosed
US-9238596-B2 Process simplification for precursor compound GE HEALTHCARE LIMITED (GB) 2016-01-19 US disclosed
US-9061977-B2 Purification of precursor compound by crystallisation GE HEALTHCARE LIMITED (GB) 2015-06-23 US disclosed
EP-2655321-A1 PURIFICATION OF PRECURSOR COMPOUND BY CRYSTALLISATION GE Healthcare UK Limited (GB) 2013-10-30 EP disclosed
EP-2655320-A1 PROCESS SIMPLIFICATION FOR PRECURSOR COMPOUND GE Healthcare UK Limited (GB) 2013-10-30 EP disclosed
US-20100016626-A1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND NIHON MEDI-PHYSICS CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128130-A1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND Nihon Medi-Physics Co., Ltd. (JP) 2009-12-02 EP disclosed
EP-1893246-A4 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING UNIV EMORY (US) 2009-05-06 EP disclosed
JP-2009029709-A METHOD FOR PRODUCING 5-(3-BENZYLOXYCYCLOBUTANE)HYDANTOIN TOKUYAMA CORP 2009-02-12 JP disclosed
EP-1893246-A2 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING Emory University (US) 2008-03-05 EP disclosed
WO-2007001958-A2 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 2007-01-04 WO disclosed
US-20060292073-A1 Stereoselective Synthesis of Amino Acid Analogs for Tumor Imaging EMORY UNIVERSITY (US) 2006-12-28 US disclosed
US-5817776-A TECHNETIUM 99 COMPLEXES, SINGLE PHOTON EMISSION TOMOGRAPHY EMORY UNIVERSITY (US) 1998-10-06 US disclosed
US-5808146-A Amino acid analogs for tumor imaging EMORY UNIVERSITY (US) 1998-09-15 US disclosed
WO-1997017092-A1 AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 1997-05-15 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 (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-20060292073-A1 Stereoselective Synthesis of Amino Acid Analogs for Tumor Imaging PAICS, BCAT1, SLC1A5 BCHE 1473/4885ACHE 4650/4885NAAA 370/4885
US-20100016626-A1 PROCESS FOR PRODUCTION OF PRECURSOR COMPOUND FOR RADIOACTIVE HALOGEN-LABELED ORGANIC COMPOUND FUS, SLC43A1, PFAS BCHE 964/4885ACHE 3218/4885NAAA 665/4885

“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.