SCHEMBL686314

SCHEMBL686314

O=S(=O)(O)c1ccc2cc3ccccc3cc2c1S(=O)(=O)O.[Na].[Na]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.45
CTRB1 P17538 1/20 0.42
MPL P40238 3/20 0.41
CTRC Q99895 2/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.40
SNCA P37840 1/20 0.40
HSD17B10 Q99714 4/20 0.39
HIF1A Q16665 2/20 0.39
CYP1B1 Q16678 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2C19 P33261 3/20 0.39
CYP2C9 P11712 2/20 0.39
CASP6 P55212 2/20 0.39
CYP1A2 P05177 2/20 0.38
ALOX15 P16050 1/20 0.38
ATIC P31939 1/20 0.38

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
SCHEMBL30108870 0.98 CYP2D6 (0.46) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL151653 0.98 CYP2D6 (0.46) CYP2D6CTRB1MPLCTRCALDH1A1
Ammonia Solution, Strong SCHEMBL30109021 0.96 CYP2D6 (0.45) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL30867080 0.85 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL4578484 0.85 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL4897459 0.85 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL8835967 0.85 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL3233255 0.85 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCALDH1A1
SCHEMBL31214797 0.84 CYP2D6 (0.42) CYP2D6ALDH1A1KDM4EGAALMNA
SCHEMBL248203 0.84 CYP2D6 (0.39) CYP2D6CTRB1MPLCTRCALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106517611-A Reclaimed water reutilization method for circulating water system 薛方勤 2017-03-22 CN claimed
CN-106517611-A Reclaimed water reutilization method for circulating water system 薛方勤 2017-03-22 CN disclosed
EP-1740506-B1 CONTROL OF COOLING WATER SYSTEM USING RATE OF CONSUMPTION OF FLUORESCENT POLYMER NALCO CO (US) 2012-02-29 EP disclosed
CN-100513331-C Control of cooling water system using rate of consumption of fluorescent polymer NALCO CO (US) 2009-07-15 CN disclosed
CN-1950304-A Control of cooling water system using rate of consumption of fluorescent polymer NALCO CO (US) 2007-04-18 CN disclosed
US-7179384-B2 Control of cooling water system using rate of consumption of fluorescent polymer NALCO COMPANY (US) 2007-02-20 US disclosed
EP-1740506-A2 CONTROL OF COOLING WATER SYSTEM USING RATE OF CONSUMPTION OF FLUORESCENT POLYMER Nalco Company (US) 2007-01-10 EP disclosed
EP-1708882-A1 METHOD OF TRACING PROCESS PRINTING FLUIDS Nalco Company (US) 2006-10-11 EP disclosed
US-20060150850-A1 Method of tracing process printing fluids ECOLAB USA INC. 2006-07-13 US disclosed
WO-2005110925-A2 CONTROL OF COOLING WATER SYSTEM USING RATE OF CONSUMPTION OF FLUORESCENT POLYMER NALCO COMPANY (US) 2005-11-24 WO disclosed
US-6966213-B2 Rapid method for detecting leaks of hydraulic fluids in production plants NALCO COMPANY (US) 2005-11-22 US disclosed
US-20050242042-A1 Control of cooling water system using rate of consumption of fluorescent polymer ECOLAB USA INC. 2005-11-03 US disclosed
WO-2005072964-A1 METHOD OF TRACING PROCESS PRINTING FLUIDS NALCO COMPANY (US) 2005-08-11 WO disclosed
US-20050166780-A1 Method of tracing process printing fluids NALCO COMPANY 2005-08-04 US disclosed
US-20050160795-A1 Rapid method for detecting leaks of hydraulic fluids in production plants ECOLAB USA INC. 2005-07-28 US disclosed