SCHEMBL733254

SCHEMBL733254

O=S(=O)([O-])C(F)(F)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)F.[La+3]

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.37
CA1 P00915 4/20 0.37
CA7 P43166 1/20 0.37
CA13 Q8N1Q1 1/20 0.37
MMP1 P03956 2/20 0.35
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
MMP8 P22894 2/20 0.35
MMP13 P45452 2/20 0.35
GPR3 P46089 1/20 0.33

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
Zinc Ion SCHEMBL734146 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
Potassium Ion SCHEMBL1294546 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL6909339 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL6914815 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL6915614 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
Silver SCHEMBL10629813 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL732960 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL20873158 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL21549837 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1
SCHEMBL6912636 0.93 CA2 (0.37) CA2CA1CA7CA13MMP1

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
US-8138136-B2 Process for production of alkylene oxide adducts KAO CORPORATION (JP) 2012-03-20 US claimed
US-20100056821-A1 PROCESS FOR PRODUCTION OF ALKYLENE OXIDE ADDUCTS KAO CORPORATION (JP) 2010-03-04 US claimed
EP-2085372-B1 PROCESS FOR PRODUCTION OF ALKYLENE OXIDE ADDUCTS KAO CORP (JP) 2016-02-17 EP disclosed
US-8138136-B2 Process for production of alkylene oxide adducts KAO CORPORATION (JP) 2012-03-20 US disclosed
US-20100056821-A1 PROCESS FOR PRODUCTION OF ALKYLENE OXIDE ADDUCTS KAO CORPORATION (JP) 2010-03-04 US disclosed
EP-2085372-A1 PROCESS FOR PRODUCTION OF ALKYLENE OXIDE ADDUCTS Kao Corporation (JP) 2009-08-05 EP disclosed
US-6201123-B1 FOR ASYMMETRIC EPOXIDATION OF ENONES; GIVES EPOXIDES HAVING AN ENHANCED OPTICAL PURITY TECHNO POLYMER CO., LTD. (JP) 2001-03-13 US disclosed