SCHEMBL538974

SCHEMBL538974

CC(C)OC(=N)N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Hydrochloric Acid SCHEMBL5837690 0.97
Sulfuric Acid SCHEMBL5837451 0.87 KDM4E (0.44)
Acetic Acid SCHEMBL31317491 0.87 TSHR (0.48)
Sulfuric Acid SCHEMBL5837457 0.81 KDM4E (0.34)
SCHEMBL8283058 0.78
SCHEMBL6031323 0.72 TSHR (0.42)
SCHEMBL16006858 0.69
SCHEMBL24804487 0.69
SCHEMBL8545100 0.69
SCHEMBL28718710 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2438069-A1 SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NeuroSearch A/S (DK) 2012-04-11 EP claimed
WO-2010112485-A1 SUBSTITUTED [1,2,4]TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-10-07 WO claimed
US-7105694-B2 Reaction of cyanamide with isopropanol and sodium hydroxide and sulfuric acid NIPPON CARBIDE KOGYO KABUSHIKI KAISHA (JP) 2006-09-12 US claimed
CN-1697827-A Novel O-isopropyl isourea salt and process for producing the same NIPPON CARBIDE KOGYO KK (JP) 2005-11-16 CN claimed
US-20050171372-A1 Novel o-isopropylisourea salts and process for the production thereof NIPPON CARBIDE KOGYO KABUSHIKI KAISHA (JP) 2005-08-04 US claimed
US-20240209160-A1 POLYMERIC DISPERSANTS FROM PHENYL GLYCIDYL ETHER STEPAN COMPANY 2024-06-27 US disclosed
US-20240209160-A1 POLYMERIC DISPERSANTS FROM PHENYL GLYCIDYL ETHER STEPAN COMPANY 2024-06-27 US disclosed
US-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-29 US disclosed
EP-4031531-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS Bial-R&D Investments, S.A. (PT) 2022-07-27 EP disclosed
US-8431704-B2 Quinoline or isoquinoline substituted P2X7 antagonists JANSSEN PHARMACEUTICA NV (BE) 2013-04-30 US disclosed
EP-2438069-A1 SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NeuroSearch A/S (DK) 2012-04-11 EP disclosed
EP-2414364-A1 SUBSTITUTED Ý1,2,4¨TRIAZOLOÝ1,5-a¨PYRIMIDINES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NeuroSearch A/S (DK) 2012-02-08 EP disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-5602264-A COMPLEXING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-02-11 US disclosed