SCHEMBL3766713

SCHEMBL3766713

NS(=O)(=O)C(F)(F)C(F)OC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
CA9 Q16790 2/20 0.34

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
SCHEMBL4379347 0.76
SCHEMBL647908 0.76 ALDH1A1 (0.32)
SCHEMBL357060 0.74 ALDH1A1 (0.31)
Potassium Ion SCHEMBL357059 0.74
Phosphine SCHEMBL4090593 0.74 ALDH1A1 (0.31)
SCHEMBL4090595 0.73
SCHEMBL15019174 0.71 CA1 (0.50) CA1CA2CA7CA13CA9
SCHEMBL8058515 0.69 CA1 (0.47) CA1CA2CA7CA13CA9
SCHEMBL18129680 0.67 CA1 (0.45) CA1CA2CA7CA13CA9
SCHEMBL1148354 0.66

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-2176332-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E. I. du Pont de Nemours and Company (US) 2010-04-21 EP disclosed
US-20090043016-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY 2009-02-12 US disclosed
WO-2009020946-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-02-12 WO disclosed