SCHEMBL5382397

SCHEMBL5382397

O=S(=O)(O)c1cc(Nc2nc(Nc3ccccc3)nc(N3CCOCC3)n2)ccc1C=Cc1ccc(Nc2nc(Nc3ccccc3)nc(N3CCOCC3)n2)cc1S(=O)(=O)O.[Na].[Na]

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.63
CA1 P00915 8/20 0.63
CA2 P00918 8/20 0.63
CA9 Q16790 8/20 0.63
LMNA P02545 2/20 0.58
HTT P42858 1/20 0.58
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 4/20 0.52
POLB P06746 2/20 0.52
TP53 P04637 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
TSHR P16473 1/20 0.49
GAA P10253 1/20 0.49
PTGS2 P35354 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL5955347 1.00 CA12 (0.63) CA12CA1CA2CA9LMNA
SCHEMBL30398437 0.99 CA12 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL29943666 0.99 CA12 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL31121933 0.99 CA12 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL461642 0.99 CA12 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL461641 0.99 CA12 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL16363738 0.98 CA12 (0.64) CA12CA1CA2CA9LMNA
SCHEMBL5955302 0.98 CA12 (0.60) CA12CA1CA2CA9LMNA
SCHEMBL5955270 0.98 CA12 (0.60) CA12CA1CA2CA9LMNA
SCHEMBL6850691 0.98 CA12 (0.60) CA12CA1CA2CA9LMNA

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728184-A1 DETERGENT COMPOSITIONS WHICH PROVIDE DYE TRANSFER INHIBITION BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1996-08-28 EP claimed
WO-1995013354-A1 DETERGENT COMPOSITIONS WHICH PROVIDE DYE TRANSFER INHIBITION BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1995-05-18 WO claimed
US-7214650-B2 Detergent compositions comprising polymeric suds enhancers which have improved mildness and skin feel THE PROCTER & GAMBLE CO. (US) 2007-05-08 US disclosed
US-7169745-B2 Hand dishwashing compositions comprising polymeric suds volume and suds duration enhancers and methods for washing with same THE PROCTER & GAMBLE CO. (US) 2007-01-30 US disclosed
US-20060035807-A1 Detergent compositions comprising polymeric suds enhancers which have improved mildness and skin feel THE PROCTER & GAMBLE COMPANY 2006-02-16 US disclosed
US-20050164898-A1 Hand dishwashing compositions comprising polymeric suds volume and suds duration enhancers and methods for washing with same RHODIA INC. 2005-07-28 US disclosed
US-6903064-B1 Detergent composition comprising polymeric suds volume and suds duration enhancers PROCTER & GAMBLE COMPANY (US) 2005-06-07 US disclosed
US-6827795-B1 Detergent composition comprising polymeric suds enhancers which have improved mildness and skin feel PROCTER & GAMBLE COMPANY 2004-12-07 US disclosed
US-6541443-B1 Mixture of phosphate and silicate THE PROCTER & GAMBLE COMPANY 2003-04-01 US disclosed
WO-2003020862-A1 PROCESS FOR INHIBITING THE DYE TRANSFER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-03-13 WO disclosed
EP-1180131-A2 DETERGENT COMPOSITIONS COMPRISING POLYMERIC SUDS VOLUME AND SUDS DURATION ENHANCERS THE PROCTER & GAMBLE COMPANY (US) 2002-02-20 EP disclosed
WO-1998016615-A1 COLORED PARTICULATE COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-04-23 WO disclosed
WO-1998001521-A9 HAND WASH LAUNDRY DETERGENT COMPOSITIONS CONTAINING A COMBINATION OF SURFACTANTS 1998-03-26 WO disclosed
WO-1998005752-A1 LAUNDRY BAR COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-02-12 WO disclosed
WO-1997042277-A1 LAUNDRY DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-11-13 WO disclosed
WO-1997042283-A1 LAUNDRY BAR COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-11-13 WO disclosed
WO-1995027037-A1 LAUNDRY DETERGENT BARS CONTAINING FABRIC SOFTENING CLAY THE PROCTER & GAMBLE COMPANY (US) 1995-10-12 WO disclosed
US-5427711-A An ion exchanger comprising the oxide of sodium and/or potassium, calcium and/or magnesium, silicon; alkalinity, water insolubility KAO CORPORATION (JP) 1995-06-27 US disclosed
EP-0550048-A1 Inorganic ion exchange material and detergent composition Kao Corporation (JP) 1993-07-07 EP disclosed
US-3940341-A Granular detergent compositions COLGATE-PALMOLIVE COMPANY (US) 1976-02-24 US disclosed