SCHEMBL1759533

SCHEMBL1759533

O=S(=O)(O)c1c(O)c(S(=O)(=O)O)c2ccccc2c1N=Nc1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.55
▸ HIF1A Q16665 3/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ CYP2C9 P11712 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ PTPRA P18433 1/20 0.54
▸ PTPRB P23467 1/20 0.54
▸ RAPGEF4 Q8WZA2 1/20 0.54
▸ MAPK1 P28482 3/20 0.53
▸ DNASE1L3 Q13609 1/20 0.53
▸ PTPN11 Q06124 1/20 0.52
▸ MPL P40238 4/20 0.50
▸ CTRC Q99895 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ PRMT1 Q99873 1/20 0.50
▸ CTRB1 P17538 1/20 0.49
▸ SENP2 Q9HC62 1/20 0.47
▸ SENP1 Q9P0U3 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
SCHEMBL2015717 0.89 CYP1A2 (0.55) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL1098620 0.89 CYP1A2 (0.58) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL8675476 0.89 CYP1A2 (0.55) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL1097950 0.86 CYP1A2 (0.58) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL9285885 0.85 CYP1A2 (0.52) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL1759557 0.80 CYP2D6 (0.53) CYP1A2MAPK1MPLSENP2SENP1
SCHEMBL16689771 0.78 CYP1A2 (0.84) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL29894000 0.78 CYP1A2 (0.72) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL27770231 0.78 CYP1A2 (0.62) CYP1A2HIF1AALDH1A1CYP2C9TSHR
SCHEMBL14400947 0.78 CYP1A2 (0.72) CYP1A2HIF1AALDH1A1CYP2C9TSHR

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
EP-2561059-A1 DETERGENT COMPOSITION The Procter & Gamble Company (US) 2013-02-27 — — EP disclosed
EP-2510092-A1 FABRIC AND HOME CARE PRODUCTS The Procter & Gamble Company (US) 2012-10-17 — — EP disclosed
EP-2499225-A1 CLEANING METHOD The Procter & Gamble Company (US) 2012-09-19 — — EP disclosed
WO-2011133457-A1 DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2011-10-27 — — WO disclosed
WO-2011072117-A1 FABRIC AND HOME CARE PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2011-06-16 — — WO disclosed
WO-2011060109-A1 CLEANING METHOD THE PROCTER & GAMBLE COMPANY (US) 2011-05-19 — — WO disclosed
WO-2010030540-A1 PARTICLES COMPRISING A HUEING DYE THE PROCTER & GAMBLE COMPANY (US) 2010-03-18 — — WO disclosed
WO-2010030541-A1 LAUNDRY PARTICLE MADE BY EXTRUSION COMPRISING A HUEING DYE THE PROCTER & GAMBLE COMPANY (US) 2010-03-18 — — WO disclosed
WO-2010030539-A1 LAUNDRY PARTICLE MADE BY EXTRUSION COMPRISING A HUEING DYE AND FATTY ACID SOAP THE PROCTER & GAMBLE COMPANY (US) 2010-03-18 — — WO disclosed
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