SCHEMBL7779116

SCHEMBL7779116

CCCCCCC(CCCC)Cc1ccc2ccccc2c1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 4/20 0.43
KDM4E B2RXH2 4/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
GAA P10253 4/20 0.34
TDP1 Q9NUW8 1/20 0.34
CNR1 P21554 4/20 0.34
CNR2 P34972 4/20 0.34
NPC1 O15118 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HTT P42858 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL7779090 0.99 SLC2A1 (0.44) SLC2A1KDM4EKMT2AL3MBTL1PRSS1
SCHEMBL7787184 0.91 SLC2A1 (0.41) SLC2A1KDM4EL3MBTL1PRSS1PRSS2
SCHEMBL9297819 0.87 SLC2A1 (0.42) SLC2A1KDM4EKMT2AL3MBTL1GAA
SCHEMBL711264 0.87 SLC2A1 (0.42) SLC2A1KDM4EKMT2AL3MBTL1GAA
SCHEMBL7787165 0.87 CYP2D6 (0.38) SLC2A1KDM4EKMT2AL3MBTL1PRSS1
SCHEMBL7779122 0.85 CYP2D6 (0.39) SLC2A1KDM4EKMT2AL3MBTL1PRSS1
SCHEMBL19137850 0.82 SLC2A1 (0.48) SLC2A1KDM4EKMT2AL3MBTL1GAA
SCHEMBL2255815 0.82 SLC2A1 (0.48) SLC2A1KDM4EKMT2AL3MBTL1GAA
SCHEMBL19137760 0.82 SLC2A1 (0.48) SLC2A1KDM4EKMT2AL3MBTL1GAA
SCHEMBL2022680 0.82 SLC2A1 (0.48) SLC2A1KDM4EKMT2AL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0803548-B1 Colored thermoplastic resin composition ORIENT CHEMICAL IND (JP) 2001-10-24 EP disclosed
US-5827911-A BLACK DYE IS OBTAINED BY REACTION OF NIGROSINE AND ATLEAST ONE ANIONIC SURFACTANT SELECTED FROM SULFURIC ACID ESTER OR SALTS, PHSOPHORIC ACID ESTER OR SALTS, SULFONIC ACID OR SALTS AND CARBOXYLIC ACID OR SALTS ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-27 US disclosed
EP-0803548-A2 Colored thermoplastic resin composition ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-29 EP disclosed