SCHEMBL7533698

SCHEMBL7533698

CCCCCCCCCCCCCCC(CC)OS(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
SMPD1 P17405 3/20 0.39
GPR84 Q9NQS5 5/20 0.38
FDPS P14324 3/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.37
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL11572649 1.00 TP53 (0.46) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL368271 1.00 TP53 (0.46) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL11515407 1.00 TP53 (0.46) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL318193 0.98 TP53 (0.47) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL27843339 0.96 TP53 (0.46) TP53SMPD1GPR84FDPSFFAR1
Methylamine SCHEMBL28297217 0.94 TP53 (0.48) TP53SMPD1GPR84FDPSCA1
Trimethylammonium SCHEMBL28467227 0.93 TP53 (0.43) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL24091301 0.92 TP53 (0.48) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL1931553 0.92 TP53 (0.48) TP53SMPD1GPR84FDPSFFAR1
SCHEMBL14431494 0.92 PTPN1 (0.40) TP53FDPSCA1CA2

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
US-6380143-B1 PERFORMANCE, ESPECIALLY UNDER HIGH WATER HARDNESS AND LOW TEMPERATURE WASH WATER CONDITIONS; FOR USE IN LAUNDERING FABRICS PROCTER & GAMBLE COMPANY, THE 2002-04-30 US disclosed
EP-1196526-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-04-17 EP disclosed
WO-2001007553-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-02-01 WO disclosed