SCHEMBL2930849

SCHEMBL2930849

O=C1CCCN1OON1CCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.46
BRD2 P25440 1/20 0.46
LMNA P02545 2/20 0.38
PIK3CD O00329 1/20 0.37
TSHR P16473 1/20 0.35
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL29159706 0.90 ALDH1A1 (0.37) BRD4BRD2LMNAPIK3CDCYP1A2
SCHEMBL6122067 0.83 BRD4 (0.46) BRD4BRD2LMNAPIK3CDTSHR
SCHEMBL5962649 0.79
SCHEMBL4635601 0.79
SCHEMBL5178300 0.79
SCHEMBL622497 0.77
SCHEMBL59156 0.77
Ammonia Solution, Strong SCHEMBL29140490 0.77
Ammonia Solution, Strong SCHEMBL11574327 0.75 BRD4 (0.39) BRD4BRD2LMNAPIK3CDTSHR
SCHEMBL565144 0.75 BRD4 (0.39) BRD4BRD2LMNAPIK3CDTSHR

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
EP-1942112-B1 Clathrates of an organosilane quaternary ammonium compound and urea and method of use RESOURCE DEV LLC (US) 2010-09-15 EP claimed
US-7589054-B2 Clathrates of an organosilane quaternary ammonium compound and urea and methods of use RESOURCE DEVELOPMENT L.L.C. (US) 2009-09-15 US claimed
WO-2008082735-A1 CLATHRATES OF AN ORGANOSILANE QUATERNARY AMMONIUM COMPOUND AND UREA AND METHODS OF USE RESOURCE DEVELOPMENT L.L.C. (US) 2008-07-10 WO claimed
EP-1942112-A1 Clathrates of an organosilane quaternary ammonium compound and urea and method of use Resource Development L.L.C. (US) 2008-07-09 EP claimed
US-20080161219-A1 CLATHRATES OF AN ORGANOSILANE QUATERNARY AMMONIUM COMPOUND AND UREA AND METHODS OF USE RESOURCE DEVELOPMENT L.L.C. 2008-07-03 US claimed
US-20120289447-A1 LIQUID DETERGENT FORMULATION CONTAINING ENZYME AND PEROXIDE IN A UNIFORM LIQUID CHURCH & DWIGHT CO., INC. (US) 2012-11-15 US disclosed
EP-1942112-B1 Clathrates of an organosilane quaternary ammonium compound and urea and method of use RESOURCE DEV LLC (US) 2010-09-15 EP disclosed
US-7589054-B2 Clathrates of an organosilane quaternary ammonium compound and urea and methods of use RESOURCE DEVELOPMENT L.L.C. (US) 2009-09-15 US disclosed
WO-2008082735-A1 CLATHRATES OF AN ORGANOSILANE QUATERNARY AMMONIUM COMPOUND AND UREA AND METHODS OF USE RESOURCE DEVELOPMENT L.L.C. (US) 2008-07-10 WO disclosed
EP-1942112-A1 Clathrates of an organosilane quaternary ammonium compound and urea and method of use Resource Development L.L.C. (US) 2008-07-09 EP disclosed
US-20080161219-A1 CLATHRATES OF AN ORGANOSILANE QUATERNARY AMMONIUM COMPOUND AND UREA AND METHODS OF USE RESOURCE DEVELOPMENT L.L.C. 2008-07-03 US disclosed