SCHEMBL81646

SCHEMBL81646

CC(=O)C(=[N+]=[N-])C(=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
Carbamic Acid SCHEMBL11020831 0.92 ACHE (0.35)
Methylene Chloride SCHEMBL27550579 0.90 TSHR (0.35)
SCHEMBL5846213 0.84
SCHEMBL8406590 0.81
SCHEMBL8748923 0.78 CES1 (0.33)
SCHEMBL20361923 0.76
SCHEMBL9404049 0.76 TDP1 (0.36)
SCHEMBL7045801 0.74
SCHEMBL11041852 0.71
SCHEMBL31619417 0.70 ALDH1A1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118406002-A Benzondole derivative and synthesis method thereof 商洛学院 2024-07-30 CN claimed
US-20160208114-A1 CONDUCTIVE POLYMERIC COATINGS, MEDICAL DEVICES, COATING SOLUTIONS AND METHODS HERAEUS MEDICAL COMPONENTS LLC 2016-07-21 US claimed
EP-3039087-A1 CONDUCTIVE POLYMERIC COATINGS, MEDICAL DEVICES, COATING SOLUTIONS AND METHODS SurModics, Inc. (US) 2016-07-06 EP claimed
WO-2015031265-A1 CONDUCTIVE POLYMERIC COATINGS, MEDICAL DEVICES, COATING SOLUTIONS AND METHODS SURMODICS, INC. (US) 2015-03-05 WO claimed
EP-1670806-B9 PROCESS FOR PREPARATION OF ESTERS OF 2-DIAZO-3-TRIMETHYLSILYLOXY-3-BUTENOIC ACID RANBAXY LAB LTD (IN) 2010-06-02 EP claimed
EP-1670806-B1 PROCESS FOR PREPARATION OF ESTERS OF 2-DIAZO-3-TRIMETHYLSILYLOXY-3-BUTENOIC ACID RANBAXY LAB LTD (IN) 2010-01-06 EP claimed
EP-1670806-A1 PROCESS FOR PREPARATION OF ESTERS OF 2-DIAZO-3-TRIMETHYLSILYLOXY-3-BUTENOIC ACID Ranbaxy Laboratories Limited (IN) 2006-06-21 EP claimed
WO-2005021560-A1 PROCESS FOR PREPARATION OF ESTERS OF 2-DIAZO-3-TRIMETHYLSILYLOXY-3-BUTENOIC ACID RANBAXY LABORATORIES LIMITED (IN) 2005-03-10 WO claimed
US-20030013696-A1 Methods and compositions for photo-cross linking photoactive compounds to target tissue BRITISH COLUMBIA, UNIVERSITY OF, THE (CA) 2003-01-16 US claimed
WO-2002076453-A1 METHODS AND COMPOSITIONS FOR PHOTO-CROSS LINKING PHOTOACTIVE COMPOUNDS TO TARGET TISSUE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2002-10-03 WO claimed
EP-0003666-B1 OXABICYCLO 3.1.0 HEXANES USEFUL IN THE PRODUCTION OF CYCLOPROPANECARBOXYLATE INSECTICIDES AND INTERMEDIATE COMPOUNDS FMC Corporation (US) 1983-04-06 EP claimed
US-4038253-A PHOTOCROSS-LINKABLE POLYMERS CONTAINING PENDANT DIAZOESTER GROUPS HERCULES INCORPORATED (US) 1977-07-26 US claimed
CN-118406002-A Benzondole derivative and synthesis method thereof 商洛学院 2024-07-30 CN disclosed
EP-4005794-B1 MEDICAL INSTRUMENT AND METHOD FOR MANUFACTURING SAME TERUMO CORP (JP) 2024-07-10 EP disclosed
US-20240100519-A1 Microfluidic Products with Controlled Fluid Flow BABCOCK BRIAN DAVID (US) 2024-03-28 US disclosed
EP-3397296-B1 LUBRICIOUS COATINGS WITH SURFACE SALT GROUPS SURMODICS INC (US) 2024-01-24 EP disclosed
US-4683296-A ANTIBIOTICS, SILATION BRISTOL-MYERS COMPANY (US) 1987-07-28 US disclosed
US-4197408-A COPPER COMPLEX CATALYST, 2,5-DIMETHYL-2,4-HEXADIEN) REACTED WITH DIAZOACETATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-04-08 US disclosed
US-4154722-A PHOTOSTABILITY CIBA-GEIGY CORPORATION (US) 1979-05-15 US disclosed
US-4038253-A PHOTOCROSS-LINKABLE POLYMERS CONTAINING PENDANT DIAZOESTER GROUPS HERCULES INCORPORATED (US) 1977-07-26 US disclosed