SCHEMBL5867043

SCHEMBL5867043

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.38
CA2 P00918 6/20 0.37
NFKB1 P19838 3/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MAPK1 P28482 1/20 0.32
GPR84 Q9NQS5 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
SCHEMBL26907859 0.84 TSHR (0.43) CA1CA2NFKB1CYP3A4TSHR
Potassium Ion SCHEMBL28727543 0.82 CA2 (0.48) CA1CA2NFKB1CYP3A4TSHR
SCHEMBL28727433 0.82 CA2 (0.48) CA1CA2NFKB1CYP3A4TSHR
SCHEMBL28729498 0.82 CA2 (0.53) CA1CA2NFKB1CYP3A4TSHR
SCHEMBL28671007 0.82 CA2 (0.48) CA1CA2NFKB1CYP3A4TSHR
Potassium Ion SCHEMBL28938759 0.80 CA1 (0.53) CA1CA2NFKB1GPR84
SCHEMBL28727668 0.80 CA1 (0.53) CA1CA2NFKB1GPR84
SCHEMBL10430541 0.79 CA2 (0.53) CA1CA2NFKB1GPR84
Pivalate SCHEMBL6561622 0.78 CA1 (0.39) CA1CA2
SCHEMBL11857441 0.74 CA1 (0.37) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098287-B2 Two-component protective lustering agent for coated surface WILLSON CO., LTD. (JP) 2006-08-29 US disclosed
US-20050004264-A1 Two-pack type water repellent for glass surface WILLSON CO., LTD. (JP) 2005-01-06 US disclosed
EP-1440952-A1 TWO−PACK TYPE WATER REPELLANT FOR GLASS SURFACE WILLSON CO., LTD. (JP) 2004-07-28 EP disclosed
US-20040054046-A1 Two-component protective lustering agent for coated surface WILLSON CO., LTD. (JP) 2004-03-18 US disclosed
EP-1380624-A1 TWO COMPONENT PROTECTIVE LUSTERING AGENT FOR COATED SURFACE WILLSON CO., LTD. (JP) 2004-01-14 EP disclosed