SCHEMBL8028659

SCHEMBL8028659

CCCCCCCCCCC(CCCCCC)C(=O)OS(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.47
ZDHHC7 Q9NXF8 1/20 0.44
TP53 P04637 1/20 0.44
CA1 P00915 1/20 0.43
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
GPR84 Q9NQS5 7/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
FAAH O00519 1/20 0.39

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
SCHEMBL9621473 0.93 CA2 (0.53) CA2ZDHHC7TP53CA1GRIK1
SCHEMBL28785188 0.91 EPHX2 (0.44) TP53FFAR1MAPTPPARDFAAH
Ammonia Solution, Strong SCHEMBL28665546 0.89 EPHX2 (0.43) TP53FFAR1MAPTPPARDFAAH
SCHEMBL3256653 0.89 GPR84 (0.49) CA2ZDHHC7GRIK1GRIK2GPR84
SCHEMBL5329390 0.87 GPR84 (0.47) CA2GRIK1GRIK2GPR84FFAR1
SCHEMBL7967486 0.86 CA2 (0.50) CA2ZDHHC7TP53CA1GPR84
SCHEMBL7996557 0.85 NAAA (0.47) CA2ZDHHC7MAPTFAAH
SCHEMBL30201505 0.84 HDAC1 (0.49) CA2TP53CA1GRIK1GRIK2
SCHEMBL8023389 0.84 CA1 (0.48) ZDHHC7TP53CA1GPR84FFAR1
SCHEMBL8012308 0.84 CA1 (0.48) ZDHHC7TP53CA1GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0631611-B1 NEUTRAL pH CLEANSING BAR PROCTER & GAMBLE (US) 2000-02-02 EP disclosed
EP-0631614-B1 SKIN pH CLEANSING BAR PROCTER & GAMBLE (US) 1999-06-09 EP disclosed
EP-0559837-B1 SHAPED SOLID MADE WITH A RIGID, INTERLOCKING MESH OF NEUTRALIZED CARBOXYLIC ACID PROCTER & GAMBLE (US) 1995-10-25 EP disclosed
EP-0631611-A1 NEUTRAL pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1995-01-04 EP disclosed
EP-0631614-A1 SKIN pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1995-01-04 EP disclosed
EP-0594703-A1 A PERSONAL CLEANSING FREEZER BAR MADE WITH A RIGID, INTERLOCKING MESH OF NEUTRALIZED CARBOXYLIC ACID. PROCTER & GAMBLE (US) 1994-05-04 EP disclosed
US-5264145-A Personal cleansing freezer bar with selected fatty acid soaps and synthetic surfactant for reduced bathtub ring, improved mildness, and good lather THE PROCTER & GAMBLE COMPANY (US) 1993-11-23 US disclosed
WO-1993019154-A1 NEUTRAL pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1993-09-30 WO disclosed
WO-1993019159-A1 SKIN PH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1993-09-30 WO disclosed
WO-1993002174-A1 A PERSONAL CLEANSING FREEZER BAR MADE WITH A RIGID, INTERLOCKING MESH OF NEUTRALIZED CARBOXYLIC ACID THE PROCTER & GAMBLE COMPANY (US) 1993-02-04 WO disclosed