SCHEMBL2920648

SCHEMBL2920648

CCCCCCCCOS(=O)(=O)[O-].C[N+](C)(CCO)CCO

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.66
GLA P06280 1/20 0.66
HPGD P15428 1/20 0.66
TSHR P16473 1/20 0.66
MAPK1 P28482 1/20 0.66
EPHX2 P34913 1/20 0.66
BLM P54132 1/20 0.66
DNM1 Q05193 3/20 0.55
CA1 P00915 9/20 0.44
CA2 P00918 9/20 0.44
CA9 Q16790 8/20 0.44
CA12 O43570 3/20 0.44
CA7 P43166 3/20 0.44
CA14 Q9ULX7 3/20 0.44
CA3 P07451 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44
CA5A P35218 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
PSMD14 O00487 1/20 0.44

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
Choline SCHEMBL3463288 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
Choline SCHEMBL3462598 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
Choline SCHEMBL18167407 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
Choline SCHEMBL3462660 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
Choline SCHEMBL3462478 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
Choline SCHEMBL3462565 0.90 RECQL (0.66) RECQLGLAHPGDTSHRMAPK1
SCHEMBL6053488 0.90 RECQL (0.70) RECQLGLAHPGDTSHRMAPK1
Didecyldimethylammonium SCHEMBL4446721 0.88 RECQL (0.72) RECQLGLAHPGDTSHRMAPK1
SCHEMBL11778706 0.86 RECQL (0.64) RECQLGLAHPGDTSHRMAPK1
SCHEMBL30277964 0.85 RECQL (0.67) RECQLGLAHPGDTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362095-B2 Defoaming of ionic liquids EVONIK GOLDSCHMIDT GMBH (DE) 2013-01-29 US disclosed
EP-2223904-A2 Method for producing antistatic artificial stones for area-measured material Evonik Goldschmidt GmbH (DE) 2010-09-01 EP disclosed
US-20100192814-A1 PROCESS FOR PRODUCING ANTISTATICALLY TREATED ARTIFICIAL STONE FOR FLAT STRUCTURES EVONIK GOLDSCHMIDT GMBH (DE) 2010-08-05 US disclosed
US-20100084597-A1 DEFOAMING OF IONIC LIQUIDS EVONIK DEGUSSA GMBH (DE) 2010-04-08 US disclosed
US-20100029519-A1 PERFORMANCE ADDITIVES FOR IMPROVING THE WETTING PROPERTIES OF IONIC LIQUIDS ON SOLID SURFACES EVONIK DEGUSSA GMBH (DE) 2010-02-04 US disclosed
EP-2093278-A1 Performance additive for improving the sprinkling characteristics of ionic fluids on solid surfaces Evonik Goldschmidt GmbH (DE) 2009-08-26 EP disclosed
EP-2087931-A2 Defoaming of ionic fluids Evonik Goldschmidt GmbH (DE) 2009-08-12 EP disclosed