SCHEMBL9927985

SCHEMBL9927985

CO[Si](CCCOCC(O)CNCCN(CC(O)COCCC[Si](OC)(OC)OC)CC(O)COCCC[Si](OC)(OC)OC)(OC)OC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASR P41180 2/20 0.36
KDM4E B2RXH2 2/20 0.34
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GRK3 P35626 1/20 0.31
KMT2A Q03164 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
SCHEMBL62323 0.95 CASR (0.34) CASRKDM4EHTTLMNAUSP2
SCHEMBL9928000 0.91 CASR (0.34) CASRKDM4EHTTLMNAUSP2
SCHEMBL18102292 0.91 HTT (0.34) CASRHTTUSP2
SCHEMBL16298576 0.91 HTT (0.35) CASRKDM4EHTTALDH1A1
SCHEMBL9928041 0.91 HTT (0.35) CASRKDM4EHTTALDH1A1
SCHEMBL9928078 0.90 CASR (0.35) CASR
SCHEMBL9928091 0.90 CASR (0.35) CASR
SCHEMBL15218971 0.90 HTT (0.34) CASRHTT
SCHEMBL14865800 0.90 CASR (0.32) CASR
SCHEMBL9927975 0.88 MMP9 (0.41) CASRKDM4EHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487408-B2 Reducing aluminosilicate scale in the bayer process NALCO COMPANY (US) 2016-11-08 US disclosed
US-9487408-B2 Reducing aluminosilicate scale in the bayer process NALCO COMPANY (US) 2016-11-08 US disclosed
US-8889096-B2 Reducing aluminosilicate scale in the bayer process NALCO COMPANY (US) 2014-11-18 US disclosed
US-8889096-B2 Reducing aluminosilicate scale in the bayer process NALCO COMPANY (US) 2014-11-18 US disclosed
WO-2013126683-A1 REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS NALCO COMPANY (US) 2013-08-29 WO disclosed
US-20120148462-A1 REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS ECOLAB USA INC. 2012-06-14 US disclosed
US-20120148462-A1 REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS ECOLAB USA INC. 2012-06-14 US disclosed
US-20110212006-A1 REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS ECOLAB USA INC. 2011-09-01 US disclosed
US-20110212006-A1 REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS ECOLAB USA INC. 2011-09-01 US disclosed