SCHEMBL7597022

SCHEMBL7597022

NC(O)(O)C(O)(O)C(N)(O)O

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
SCHEMBL125130 0.76
SCHEMBL8907379 0.71
SCHEMBL11661767 0.71
SCHEMBL15321998 0.68 MEN1 (0.33)
SCHEMBL278341 0.68
SCHEMBL63557 0.68
SCHEMBL9326718 0.68
Water SCHEMBL11252824 0.67
Hydrochloric Acid SCHEMBL10457037 0.67
SCHEMBL25205874 0.63

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104264154-A Steel rust inhibitor and antirust technology thereof HUA WENWEI 2015-01-07 CN claimed
CN-107531941-B Viscous water-based composition 花王株式会社 2021-03-12 CN disclosed
CN-104264154-A Steel rust inhibitor and antirust technology thereof HUA WENWEI 2015-01-07 CN disclosed
EP-0802067-B1 DIRECT DRAWING TYPE WATERLESS PLANOGRAPHIC ORIGINAL FORM PLATE TORAY INDUSTRIES (JP) 2002-04-24 EP disclosed
US-6096476-A DIRECTLY IMAGEABLE RAW PLATE HAVING A HEAT INSULATING LAYER, HEAT SENSITIVE LAYER COMPRISING A LIGHT TO HEAT CONVERTING MATERIAL AND INK REPLELLENT LAYER IN THIS ORDER ON SUBSTRATE; PLATE HAS SPECIFIED ELASTIC MODULUS AND TENSILE PROPERTIES TORAY INDUSTRIES, INC. (JP) 2000-08-01 US disclosed
EP-0583860-B1 Dry planographic printing plate TORAY INDUSTRIES (JP) 1998-07-22 EP disclosed
EP-0802067-A1 DIRECT DRAWING TYPE WATERLESS PLANOGRAPHIC ORIGINAL FORM PLATE TORAY INDUSTRIES, INC. (JP) 1997-10-22 EP disclosed
US-5397681-A Laminate used for the production of a dry planographic printing plate TORAY INDUSTRIES, INC. (JP) 1995-03-14 US disclosed
EP-0583860-A2 Dry planographic printing plate TORAY INDUSTRIES, INC. (JP) 1994-02-23 EP disclosed
EP-0053389-B1 PROCESS FOR PREPARING CATIONIC SURFACE ACTIVE AGENTS TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1985-04-03 EP disclosed
US-4385184-A QUATERNARYL AMMONIUM WITH HYDROXYPHENETHYL GROUP TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1983-05-24 US disclosed