SCHEMBL1834730

SCHEMBL1834730

CCCCC(CC)C(=O)OC(C)COCC(C)OC(=O)C(CC)CCCC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.58
CA1 P00915 4/20 0.58
MAPK1 P28482 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.41
FAAH O00519 1/20 0.41
ATM Q13315 2/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.39
XBP1 P17861 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 1/20 0.36
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.34

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
SCHEMBL149487 0.90 CA2 (0.58) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL23581684 0.87 CA2 (0.63) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL7217652 0.87 CA2 (0.63) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL392471 0.84 CA2 (0.59) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL6061515 0.84 CA2 (0.51) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL1836908 0.84 CA2 (0.51) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL6061313 0.84 CA2 (0.51) CA2CA1MAPK1L3MBTL1FAAH
SCHEMBL246299 0.83 FAAH (0.59) CA2CA1MAPK1FAAHALDH1A1
SCHEMBL7223074 0.83 FAAH (0.59) CA2CA1MAPK1FAAHALDH1A1
SCHEMBL1377605 0.83 FAAH (0.59) CA2CA1MAPK1FAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9399715-B2 Low VOC additives for extending the wet edge and open time of aqueous coatings EASTMAN CHEMICAL COMPANY (US) 2016-07-26 US claimed
US-20110218285-A1 LOW VOC ADDITIVES FOR EXTENDING THE WET EDGE AND OPEN TIME OF AQUEOUS COATINGS EASTMAN CHEMICAL COMPANY (US) 2011-09-08 US claimed
WO-2023205630-A1 ION DETECTION WITHOUT OPTICAL INTERFERENCE FROM SAMPLES VIRGINIA COMMONWEALTH UNIVERSITY (US) 2023-10-26 WO disclosed
US-9399715-B2 Low VOC additives for extending the wet edge and open time of aqueous coatings EASTMAN CHEMICAL COMPANY (US) 2016-07-26 US disclosed
EP-2457960-B1 Low VOC additives for extending the wet edge and open time of aqueous coatings EASTMAN CHEM CO (US) 2014-11-12 EP disclosed
EP-2321374-B1 LOW VOC ADDITIVES FOR EXTENDING THE WET EDGE AND OPEN TIME OF AQUEOUS COATINGS EASTMAN CHEM CO (US) 2013-08-14 EP disclosed
EP-2457960-A1 Low VOC additives for extending the wet edge and open time of aqueous coatings Eastman Chemical Company (US) 2012-05-30 EP disclosed
US-20110218285-A1 LOW VOC ADDITIVES FOR EXTENDING THE WET EDGE AND OPEN TIME OF AQUEOUS COATINGS EASTMAN CHEMICAL COMPANY (US) 2011-09-08 US disclosed
EP-2321374-A1 LOW VOC ADDITIVES FOR EXTENDING THE WET EDGE AND OPEN TIME OF AQUEOUS COATINGS Eastman Chemical Company (US) 2011-05-18 EP disclosed
WO-2010027487-A1 LOW VOC ADDITIVES FOR EXTENDING THE WET EDGE AND OPEN TIME OF AQUEOUS COATINGS EASTMAN CHEMICAL COMPANY (US) 2010-03-11 WO disclosed