SCHEMBL1244556

SCHEMBL1244556

CCCOC(=O)C1CCCCC(C)C1C(=O)OCCC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.46
PTPN1 P18031 2/20 0.46
PPP1CC P36873 2/20 0.46
EPHX1 P07099 1/20 0.39
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL1195396 0.97 PPM1B (0.46) PPM1BPTPN1PPP1CCEPHX1TP53
SCHEMBL1246324 0.90 PPM1B (0.53) PPM1BPTPN1PPP1CCALDH1A1NPSR1
SCHEMBL3412445 0.88 EPHX1 (0.47) PPM1BPTPN1PPP1CCEPHX1TP53
SCHEMBL3289323 0.88 EPHX1 (0.47) PPM1BPTPN1PPP1CCEPHX1TP53
SCHEMBL1196009 0.88 PPARG (0.43) EPHX1NPSR1
SCHEMBL1196345 0.88 PPARG (0.43) EPHX1NPSR1
SCHEMBL27709944 0.87 PPM1B (0.51) PPM1BPTPN1PPP1CCEPHX1TP53
SCHEMBL1246410 0.87 PPM1B (0.44) PPM1BPTPN1PPP1CCEPHX1TP53
SCHEMBL1196561 0.87 ALDH1A1 (0.39) PPM1BPTPN1PPP1CCEPHX1ALDH1A1
SCHEMBL1196645 0.86 PPM1B (0.44) PPM1BPTPN1PPP1CCEPHX1TP53

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