SCHEMBL2461092

SCHEMBL2461092

CCCN(CCC)N(CC)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
CA2 P00918 1/20 0.36
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
FFAR3 O14843 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
CA1 P00915 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL2835190 0.81 FFAR3 (0.35) TSHRFFAR3HDAC3HDAC1HDAC2
SCHEMBL28835955 0.81
SCHEMBL11330893 0.78 CA12 (0.42) CA12CA9CA2TSHRMAPK1
SCHEMBL5784743 0.78 FFAR3 (0.41) TSHRFFAR3HDAC3HDAC1HDAC2
SCHEMBL7723110 0.73 CA12 (0.43) CA12CA9TSHRCA1ALDH1A1
SCHEMBL3324870 0.73 CA12 (0.41) CA12CA9TSHRCA1ALDH1A1
SCHEMBL2834874 0.73 CA12 (0.31) CA12CA9CA2
SCHEMBL3285301 0.73 ZDHHC20 (0.38) CA12CA9CA2TSHRALDH1A1
SCHEMBL11649571 0.73 FFAR3 (0.37) TSHRFFAR3HDAC3HDAC1HDAC2
SCHEMBL794225 0.72 CA12 (0.37) CA12CA9CA2TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0774897-A4 MULTILAYERED BIOCIDAL FILM COMPOSITIONS SOUTHWEST RES INST (US) 2000-08-09 EP claimed
EP-0774900-A4 SUSTAINED RELEASE BIOCIDAL COMPOSITIONS SOUTHWEST RES INST (US) 2000-08-09 EP claimed
US-6046243-A PROVIDING A LIQUID CONTAINING CARBOXYLIC ACID ESTER OF POLYHYDRIC ALCOHOL, MIXING PHOSPHORUS PENTAOXIDE INTO THE LIQUID TO FORM AN INTERMEDITAE, MIXING SILICATE OR SILANE INTO INTERMEDIATE TO FORM A PRODUCT, COOLING THE PRODUCT BERNARD TECHNOLOGIES, INC. (US) 2000-04-04 US claimed
EP-0611163-B1 Polymeric biocidal composition and method for making same SOUTHWEST RES INST (US) 1999-10-20 EP claimed
US-5705092-A SUSTAINED RELEASE OF CHLORINE DIOXIDE; FOOD PACKAGES, MEDICAL EQUIPMENT SOUTHWEST RESEARCH INSTITUTE (US) 1998-01-06 US claimed
US-5650446-A BACTERICIDES, FUNGICIDES AND VIRICIDES SOUTHWEST RESEARCH INSTITUTE (US) 1997-07-22 US claimed
EP-0774897-A1 MULTILAYERED BIOCIDAL FILM COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1997-05-28 EP claimed
EP-0774900-A1 SUSTAINED RELEASE BIOCIDAL COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1997-05-28 EP claimed
WO-1996039028-A1 MULTILAYERED BIOCIDAL FILM COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO claimed
WO-1996039030-A1 SUSTAINED RELEASE BIOCIDAL COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO claimed
EP-1542556-B1 ANTIMICROBIAL BODY COVERING ARTICLES BERNARD TECHNOLOGIES INC (US) 2011-09-21 EP disclosed
US-7449194-B2 Which generate and release gas upon activation by electromagnetic energy and/or moisture MICROACTIVE CORP. (US) 2008-11-11 US disclosed
EP-1542556-A4 ANTIMICROBIAL BODY COVERING ARTICLES BERNARD TECHNOLOGIES INC (US) 2007-08-15 EP disclosed
US-20060216496-A2 Gas Generating Polymers BERNARD TECHNOLOGIES, INC. (US) 2006-09-28 US disclosed
EP-0774899-B1 SUSTAINED RELEASE, TRANSPARENT BIOCIDAL COMPOSITIONS BERNARD TECHNOLOGIES INC (US) 2006-04-05 EP disclosed
WO-1996039028-A1 MULTILAYERED BIOCIDAL FILM COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO disclosed
WO-1996039029-A1 METHODS OF MAKING SUSTAINED RELEASE BIOCIDAL COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO disclosed
WO-1996039030-A1 SUSTAINED RELEASE BIOCIDAL COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO disclosed
WO-1996039296-A1 POWDERED BIOCIDAL COMPOSITIONS SOUTHWEST RESEARCH INSTITUTE (US) 1996-12-12 WO disclosed
WO-1996039200-A1 SUSTAINED RELEASE BIOCIDAL COMPOSITIONS AND THEIR USES BERNARD TECHNOLOGIES, INC. (US) 1996-12-12 WO disclosed