SCHEMBL1405299

SCHEMBL1405299

CCCCC(CCCC)OC(CCC)O[Sn]

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
DNM1 Q05193 2/20 0.31

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
SCHEMBL2541482 0.76 DNM1 (0.39) CTSKCA1CA2ALDH1A1CYP3A4
SCHEMBL5524610 0.76 DNM1 (0.39) CA1CA2ALDH1A1CYP3A4TSHR
SCHEMBL2843204 0.75 DNM1 (0.43) CA1CA2ALDH1A1CYP3A4TSHR
Ammonia Solution, Strong SCHEMBL1333604 0.73 DNM1 (0.41) CA1CA2ALDH1A1CYP3A4TSHR
SCHEMBL14747631 0.72 DNM1 (0.36) CTSKCA1CA2ALDH1A1CYP3A4
SCHEMBL1609566 0.71 DNM1 (0.32) DNM1
SCHEMBL3808027 0.71 DNM1 (0.46) CA2TSHRDNM1
SCHEMBL1608621 0.70 ALDH1A1 (0.32) CA1CA2ALDH1A1CYP3A4TSHR
SCHEMBL1933190 0.69 DNM1 (0.50) CA2TSHRDNM1
SCHEMBL1932169 0.69 DNM1 (0.50) CA2TSHRDNM1

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
WO-2012095861-A1 METHOD FOR PREPARING RECYCLED POLYETHYLENE TEREPHTHALATE RELIANCE INDUSTRIES LIMITED (IN) 2012-07-19 WO disclosed
EP-1989245-B1 POLYESTER SOLID PHASE POLYMERIZATION CATALYST FOR LOW ACETALDEHYDE GENERATING RESINS M & G POLIMERI ITALIA SPA (IT) 2011-03-09 EP disclosed
US-20070191582-A1 POLYESTER SOLID PHASE POLYMERIZATION CATALYST FOR LOW ACETALDEHYDE GENERATING RESINS Corpus Christi Polymers LLC 2007-08-16 US disclosed
EP-0419254-A2 Polyester compositions and organotin esterification catalysts therefor ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-03-27 EP disclosed
US-4970288-A FOOD, BEVERAGE AND DRUG PACKAGING ATOCHEM NORTH AMERICA, INC. (US) 1990-11-13 US disclosed