SCHEMBL1841018

SCHEMBL1841018

CCOC(=O)[C@H](CS)NCCN[C@@H](CS)C(=O)OCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAD P27708 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CPB2 Q96IY4 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.37
ALOX15 P16050 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
NFKB1 P19838 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
SCHEMBL21381783 1.00 CAD (0.41) CADL3MBTL1CPB2MGAMGAA
Hydrochloric Acid SCHEMBL23522225 0.98 CAD (0.40) CADL3MBTL1CPB2MGAMGAA
Hydrochloric Acid SCHEMBL30161768 0.98 CAD (0.40) CADL3MBTL1CPB2MGAMGAA
SCHEMBL28761538 0.93 SMN1; SMN2 (0.44) CADL3MBTL1CPB2MGAMGAA
SCHEMBL10523453 0.92 CAD (0.39) CADL3MBTL1CPB2MGAMGAA
SCHEMBL21082352 0.89 CAD (0.35) CADL3MBTL1CPB2MGAMGAA
SCHEMBL4991214 0.89 CAD (0.35) CADL3MBTL1CPB2MGAMGAA
SCHEMBL17385231 0.89 CPB2 (0.46) CADL3MBTL1CPB2MGAMGAA
SCHEMBL10523433 0.87 TSHR (0.40) CADL3MBTL1CPB2KMT2APOLB
SCHEMBL8768440 0.86 CAD (0.40) CADL3MBTL1CPB2MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025111482-A1 COMPLEXING AGENT SALT FORMULATIONS OF PHARMACEUTICAL COMPOUNDS AT LOW STOICHIOMETRIC RATIOS BEXSON BIOMEDICAL, INC. (US) 2025-05-30 WO claimed
US-20240390364-A1 Novel Pyridine Compositions and their use in methods for preventing or treating diseases, disorders and conditions REID CHRISTOPHER BRIAN (US) 2024-11-28 US claimed
US-20090209740-A1 COMPOSITION FOR PREPARATION OF RADIOACTIVE PHARMACEUTICAL FOR DIAGNOSIS OF REGIONAL CEREBRAL BLOOD FLOW FUJIFILM RI PHARMA CO., LTD (JP) 2009-08-20 US claimed
EP-2000154-A9 COMPOSITION FOR PREPARATION OF RADIOACTIVE PHARMACEUTICAL FOR DIAGNOSIS OF REGIONAL CEREBRAL BLOOD FLOW Fujifilm RI Pharma Co., Ltd. (JP) 2009-03-18 EP claimed
EP-2000154-A2 COMPOSITION FOR PREPARATION OF RADIOACTIVE PHARMACEUTICAL FOR DIAGNOSIS OF REGIONAL CEREBRAL BLOOD FLOW Fujifilm RI Pharma Co., Ltd. (JP) 2008-12-10 EP claimed
US-5280015-A 2-substituted adenosines and 2-substituted adenosine 5'-carboxamides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-01-18 US claimed
EP-4731194-A1 MATERIALS AND METHODS FOR MITIGATING THE PRESENCE OF NITROSAMINES IN PACKAGING USING AN ACTIVE AGENT CSP Technologies, Inc. (US) 2026-04-29 EP disclosed
US-12514525-B2 Radiopharmaceutical dispensing systems JUBILANT DRAXIMAGE INC. (CA) 2026-01-06 US disclosed
WO-2025264260-A1 MATERIALS AND METHODS FOR MITIGATING THE PRESENCE OF NITROSAMINES IN PACKAGING USING AN ACTIVE AGENT CSP TECHNOLOGIES, INC. (US) 2025-12-26 WO disclosed
US-20250367121-A1 DOSAGE FORMS COMPRISING ACTIVE PHARMACEUTICAL INGREDIENTS AXSOME THERAPEUTICS INC (US) 2025-12-04 US disclosed
WO-2025111482-A1 COMPLEXING AGENT SALT FORMULATIONS OF PHARMACEUTICAL COMPOUNDS AT LOW STOICHIOMETRIC RATIOS BEXSON BIOMEDICAL, INC. (US) 2025-05-30 WO disclosed
WO-2024263560-A1 MATERIALS AND METHODS FOR MITIGATING THE PRESENCE OF NITROSAMINES IN PACKAGING USING AN ACTIVE AGENT CSP TECHNOLOGIES, INC. (US) 2024-12-26 WO disclosed
US-20240390364-A1 Novel Pyridine Compositions and their use in methods for preventing or treating diseases, disorders and conditions REID CHRISTOPHER BRIAN (US) 2024-11-28 US disclosed
WO-2007111020-A1 COMPOSITION FOR PREPARATION OF RADIOACTIVE PHARMACEUTICAL FOR DIAGNOSIS OF REGIONAL CEREBRAL BLOOD FLOW FUJIFILM RI PHARMA CO., LTD. (JP) 2007-10-04 WO disclosed
US-6403054-B1 MEDICAL DIAGNOSIS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-06-11 US disclosed
EP-0984791-A1 TERNARY LIGAND COMPLEXES USEFUL AS RADIOPHARMACEUTICALS Du Pont Pharmaceuticals Company (US) 2000-03-15 EP disclosed
US-5986074-A CHELATE COMPOUNDS AS IMAGING AGENTS AND KITS EMORY UNIVERSITY (US) 1999-11-16 US disclosed
US-5955053-A TECHNETIUM OR RHENIUM CHELATES WITH LIGANDS SUCH AS DITHIOUREA, CYSTEINYLETHYLENE OR THIOACETAMIDETHIOUREA FOR IMAGES EMORY UNIVERSITY (US) 1999-09-21 US disclosed
WO-1998053858-A1 TERNARY LIGAND COMPLEXES USEFUL AS RADIOPHARMACEUTICALS DU PONT PHARMACEUTICALS COMPANY (US) 1998-12-03 WO disclosed
US-5280015-A 2-substituted adenosines and 2-substituted adenosine 5'-carboxamides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-01-18 US disclosed