SCHEMBL7784484

SCHEMBL7784484

CCCCCCCCCCCC(CC)C(=O)OC

nearest known ligand 0.85

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.85
CA1 P00915 4/20 0.85
ZDHHC7 Q9NXF8 1/20 0.61
MAPK1 P28482 1/20 0.50
BIRC2 Q13490 4/20 0.49
ABCB1 P08183 1/20 0.47
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
GRIK1 P39086 1/20 0.44
GRIK2 Q13002 1/20 0.44
GPR84 Q9NQS5 2/20 0.44

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
SCHEMBL3675199 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL8963954 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL2530669 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL7083633 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL2531207 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL11650069 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL5741113 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL3178684 1.00 CA2 (0.85) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL4361741 0.98 CA2 (0.88) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL17617133 0.92 CA2 (1.00) CA2CA1ZDHHC7MAPK1BIRC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001520304-A 2001-10-30 JP claimed
EP-1025190-A2 FATTY ACIDS, SOAPS, SURFACTANT SYSTEMS, AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2000-08-09 EP claimed
WO-1999020722-A2 FATTY ACIDS, SOAPS, SURFACTANT SYSTEMS, AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 1999-04-29 WO claimed
US-4118404-A TWO-STEP REACTION OF A MONOALKANOLAMINE AND A DIALKANOLAMINE WITH AN ALIPHATIC ESTER MIXTURE; BASIC CATALYST ETHYL CORPORATION (US) 1978-10-03 US claimed
EP-1025190-A2 FATTY ACIDS, SOAPS, SURFACTANT SYSTEMS, AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2000-08-09 EP disclosed
WO-1999020722-A2 FATTY ACIDS, SOAPS, SURFACTANT SYSTEMS, AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 1999-04-29 WO disclosed
US-4118404-A TWO-STEP REACTION OF A MONOALKANOLAMINE AND A DIALKANOLAMINE WITH AN ALIPHATIC ESTER MIXTURE; BASIC CATALYST ETHYL CORPORATION (US) 1978-10-03 US disclosed