SCHEMBL6153657

SCHEMBL6153657

CC(C)CC(C)(C)CC(=O)Oc1ccccc1S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
ACLY P53396 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 2/20 0.32
MYC P01106 1/20 0.32
ELANE P08246 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
CASR P41180 1/20 0.32
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
ATM Q13315 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CTSS P25774 1/20 0.31

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
SCHEMBL4956522 0.78 CYP1A2 (0.40) CYP1A2ACLYALDH1A1KMT2AMAPT
SCHEMBL29442454 0.78 CYP1A2 (0.40) CYP1A2ACLYALDH1A1KMT2AMAPT
SCHEMBL27918649 0.77 ACLY (0.50) CYP1A2ACLYALDH1A1KDM4EHSD17B10
SCHEMBL28371379 0.77 CYP1A2 (0.39) CYP1A2ACLYALDH1A1KMT2AMAPT
SCHEMBL9632703 0.77 L3MBTL1 (0.43) ALDH1A1GAASMN1; SMN2KMT2AMAPT
SCHEMBL10499169 0.74 ACLY (0.36) CYP1A2ACLYALDH1A1KDM4EHSD17B10
SCHEMBL290514 0.74 KDM4E (0.42) CYP1A2ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL6152590 0.72 KDM4E (0.60) ACLYKDM4EKMT2AMEN1RECQL
SCHEMBL8817199 0.72 ELANE (0.59) ALDH1A1KMT2AMAPTLMNAMYC
SCHEMBL29753992 0.72 PTGS2 (0.52) CYP1A2ALDH1A1KDM4EHSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1325107-B1 LAUNDERING AID FOR PREVENTING DYE TRANSFER PROCTER & GAMBLE (US) 2005-08-03 EP disclosed
US-6887524-B2 Method for manufacturing laundry additive article THE PROCTER & GAMBLE COMPANY (US) 2005-05-03 US disclosed
US-6833336-B2 To remove extraneous dyes from a wash solution before redeposition onto other articles and/or garments can occur THE PROCTER & GAMBLE COMPANY 2004-12-21 US disclosed
US-20030158075-A1 Laundering aid for preventing dye transfer THE PROCTER & GAMBLE COMPANY 2003-08-21 US disclosed
EP-1325107-A1 LAUNDERING AID FOR PREVENTING DYE TRANSFER The Procter & Gamble Company (US) 2003-07-09 EP disclosed
US-20030118730-A1 Method for manufacturing laundry additive article PROCTER & GAMBLE COMPANY, THE 2003-06-26 US disclosed
WO-2003031559-A1 METHOD FOR MANUFACTURING LAUNDRY ADDITIVE ARTICLE THE PROCTER & GAMBLE COMPANY (US) 2003-04-17 WO disclosed
WO-2002033040-A1 LAUNDERING AID FOR PREVENTING DYE TRANSFER THE PROCTER & GAMBLE COMPANY (US) 2002-04-25 WO disclosed