SCHEMBL1245663

SCHEMBL1245663

CCCOC(=O)C1CCCC1C(=O)OCCC

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.47
PTPN1 P18031 1/20 0.47
PPP1CC P36873 1/20 0.47
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HCAR2 Q8TDS4 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.34
ESR1 P03372 1/20 0.33
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A2 P23975 1/20 0.33
KDR P35968 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
EPHX2 P34913 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
SCHEMBL234736 0.96 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1245769 0.96 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1245768 0.96 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1246344 0.94 TP53 (0.48) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL14204531 0.92 PPM1B (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL13856001 0.92 PPM1B (0.42) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1296111 0.90 TP53 (0.46) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1298604 0.90 PPM1B (0.51) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1246350 0.89 PPM1B (0.41) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL15109434 0.88 PPM1B (0.42) PPM1BPTPN1PPP1CCTP53CYP3A4

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