SCHEMBL6905746

SCHEMBL6905746

CC(O)C(=O)C1(C)C=CC=CC1

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
SCHEMBL7535171 0.77
SCHEMBL8521845 0.77
SCHEMBL1044296 0.75 CYP3A4 (0.34)
SCHEMBL1767501 0.75 CYP3A4 (0.31)
SCHEMBL31259143 0.74
SCHEMBL28199374 0.74 PKM (0.32)
SCHEMBL5347884 0.72 MEN1 (0.33)
SCHEMBL4229895 0.71 MAPK1 (0.38)
SCHEMBL28206514 0.69 DGAT1 (0.31)
SCHEMBL13157265 0.68 POLB (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9976974-B2 Osmolarity-responsive hydrogel sensors and method of use UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2018-05-22 US disclosed
US-20160216221-A1 OSMOLARITY-RESPONSIVE HYDROGEL SENSORS AND METHOD OF USE UNIVERSITY OF UTAH RESEARCH FOUNDATION 2016-07-28 US disclosed
US-6800278-B1 HIGH CATIONICITY ACRYLATE OR ACRYLAMIDE POLYMER; NONIRRITA-TING; ABSORBS EXUDATES; ENHANCES STERILE ENVIRONMENT; LOOSE ADHESION; NO RESIDUE BALLARD MEDICAL PRODUCTS, INC. 2004-10-05 US disclosed
EP-1123104-B1 INHERENTLY ANTIMICROBIAL QUATERNARY AMINE HYDROGEL WOUND DRESSINGS BALLARD MED PROD (US) 2004-07-14 EP disclosed
EP-1123104-A4 INHERENTLY ANTIMICROBIAL QUATERNARY AMINE HYDROGEL WOUND DRESSINGS BALLARD MED PROD (US) 2002-07-17 EP disclosed
EP-1123104-A1 INHERENTLY ANTIMICROBIAL QUATERNARY AMINE HYDROGEL WOUND DRESSINGS BALLARD MEDICAL PRODUCTS INC. (US) 2001-08-16 EP disclosed
US-6039940-A DRESSINGS FOR WOUNDS WITH MICROBIOCIDES BALLARD MEDICAL PRODUCTS (US) 2000-03-21 US disclosed
WO-2000012100-A1 INHERENTLY ANTIMICROBIAL QUATERNARY AMINE HYDROGEL WOUND DRESSINGS BALLARD MEDICAL PRODUCTS, INC. (US) 2000-03-09 WO disclosed