SCHEMBL1245768

SCHEMBL1245768

CCCOC(=O)[C@H]1CCCC[C@@H]1C(=O)OCCC

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
PPM1B O75688 1/20 0.47
PTPN1 P18031 1/20 0.47
PPP1CC P36873 1/20 0.47
HCAR2 Q8TDS4 1/20 0.36
ALDH1A1 P00352 2/20 0.35
NAAA Q02083 1/20 0.35
EPHX1 P07099 1/20 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
SCHEMBL1245769 1.00 TP53 (0.50) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL234736 1.00 TP53 (0.50) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1246344 0.98 TP53 (0.48) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1245663 0.96 PPM1B (0.47) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1296111 0.94 TP53 (0.46) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1296973 0.92 TP53 (0.44) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1296334 0.92 ALDH1A1 (0.45) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL13856011 0.92 TP53 (0.44) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1297101 0.92 TP53 (0.44) TP53CYP3A4PPM1BPTPN1PPP1CC
SCHEMBL1296712 0.92 PPM1B (0.50) TP53CYP3A4PPM1BPTPN1PPP1CC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593175-B2 Solid titanium catalyst component for ethylene polymerization, ethylene polymerization catalyst and ethylene polymerization method MITSUI CHEMICALS, INC. (JP) 2017-03-14 US disclosed
EP-2264075-B1 SOLID TITANIUM CATALYST COMPONENT FOR ETHYLENE POLYMERIZATION, ETHYLENE POLYMERIZATION CATALYST AND ETHYLENE POLYMERIZATION METHOD MITSUI CHEMICALS INC (JP) 2016-05-25 EP disclosed
US-8383541-B2 Solid titanium catalyst component for ethylene polymerization, ethylene polymerization catalyst and ethylene polymerization method MITSUI CHEMICALS, INC. (JP) 2013-02-26 US disclosed
US-20110269924-A1 SOLID TITANIUM CATALYST COMPONENT FOR ETHYLENE POLYMERIZATION, ETHYLENE POLYMERIZATION CATALYST AND ETHYLENE POLYMERIZATION METHOD MITSUI CHEMICALS, INC. 2011-11-03 US disclosed
US-20110034648-A1 SOLID TITANIUM CATALYST COMPONENT FOR ETHYLENE POLYMERIZATION, ETHYLENE POLYMERIZATION CATALYST AND ETHYLENE POLYMERIZATION METHOD MITSUI CHEMICALS (JP) 2011-02-10 US disclosed
EP-2264075-A1 SOLID TITANIUM CATALYST COMPONENT FOR ETHYLENE POLYMERIZATION, ETHYLENE POLYMERIZATION CATALYST AND ETHYLENE POLYMERIZATION METHOD Mitsui Chemicals, Inc. (JP) 2010-12-22 EP disclosed