SCHEMBL4446797

SCHEMBL4446797

CCCCCCCCC(CCCCCCCC)(CCCC(=O)[O-])C(=O)[O-].CCCCCCCC[Sn+2]CCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
FABP3 P05413 7/20 0.44
NFKB1 P19838 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
CES2 O00748 3/20 0.37
CES1 P23141 3/20 0.37
GGPS1 O95749 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
SCHEMBL4447843 1.00 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL674621 0.97 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL30395550 0.92 CES2 (0.39) CES2CES1GGPS1
SCHEMBL29028203 0.89 CES2 (0.39) CES2CES1GGPS1
Zinc Ion SCHEMBL5681976 0.85 FABP3 (0.55) CA1FABP3NFKB1CES2CES1
SCHEMBL674800 0.84 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL674331 0.84 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL4452373 0.84 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL4445011 0.84 CA1 (0.44) CA1FABP3NFKB1GPR84CES2
SCHEMBL3764830 0.84 CA2 (0.49) CA1FABP3NFKB1GPR84

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-1958980-B1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR CORP (JP) 2012-10-31 EP disclosed
US-20090270525-A1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR CORPORATION (JP) 2009-10-29 US disclosed
EP-1958980-A1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR Corporation (JP) 2008-08-20 EP disclosed