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SCHEMBL4986513

SCHEMBL4986513

CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CC(C)CCCCCC(S)(CCCCCC(C)C)C(=O)[O-].CCCC[Sn+2].CCCC[Sn+2].[S-2].[S-2].[S-2]

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.37
▸ CA2 P00918 1/20 0.35
▸ GPR84 Q9NQS5 4/20 0.33
▸ ACE2 Q9BYF1 1/20 0.31
▸ NFKB1 P19838 1/20 0.30
▸ FFAR1 O14842 1/20 0.30

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
SCHEMBL4988056 0.88 CA1 (0.35) CA1CA2
SCHEMBL3680731 0.88 CA1 (0.35) CA1CA2
SCHEMBL11558563 0.86 CA1 (0.36) CA1CA2
SCHEMBL10987578 0.85 CA1 (0.38) CA1CA2
Zinc Ion SCHEMBL1318045 0.85 CA1 (0.38) CA1CA2
SCHEMBL2083946 0.83 CA1 (0.37) CA1CA2GPR84ACE2NFKB1
SCHEMBL351906 0.82 CA1 (0.39) CA1CA2GPR84ACE2NFKB1
SCHEMBL183669 0.82 CA1 (0.35) CA1CA2
SCHEMBL28663086 0.81 CA1 (0.38) CA1CA2GPR84ACE2NFKB1
SCHEMBL11224429 0.74 DGKA (0.35) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907844-B1 RESIN COMPOSITION FOR PRINTING FILM AND PRINTING FILM ADEKA CORP (JP) 2017-09-20 — — EP disclosed
US-20150232626-A1 RESIN COMPOSITION FOR PRINTING FILM AND PRINTING FILM ADEKA CORPORATION (JP) 2015-08-20 — — US disclosed
EP-2907844-A1 RESIN COMPOSITION FOR PRINTING FILM AND PRINTING FILM Adeka Corporation (JP) 2015-08-19 — — EP disclosed
US-8513336-B2 Flame-retardant chlorine-containing resin composition ADEKA CORPORATION (JP) 2013-08-20 — — US disclosed
US-7405252-B2 Vinyl chloride resin composition ADEKA CORPORATION (JP) 2008-07-29 — — US disclosed
US-20080045635-A1 Vinyl Chloride Resin Composition ADEKA CORPORATION (JP) 2008-02-21 — — US disclosed
US-20070100049-A1 Vinyl Chlodride Resin Composition ADEKA CORPORATION (JP) 2007-05-03 — — US disclosed
US-7041265-B2 Alkaline earth metal-basic silicate particle MIZUSAWA INDUSTRIAL CHEMICALS (JP) 2006-05-09 — — US disclosed
US-20040147660-A1 Alkaline earth metal-basic silicate particle MIZUSAWA INDUSTRIAL CHEMICALS (JP) 2004-07-29 — — US disclosed