SCHEMBL1196652

SCHEMBL1196652

CC(C)COC(=O)C1CCCC(C)CC1C(=O)OCC(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
RAB9A P51151 2/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
EPHX1 P07099 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.33
HTT P42858 1/20 0.33
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
CHRM3 P20309 2/20 0.32
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
CHRM5 P08912 1/20 0.30
CHRM1 P11229 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
SCHEMBL1196079 0.91 TRPM8 (0.43) TSHRRAB9ATRPM8TP53CYP3A4
SCHEMBL1169704 0.89 TSHR (0.45) TSHRRAB9ATP53CYP3A4HSP90AA1
SCHEMBL28550950 0.86 TP53 (0.48) TSHRRAB9ATP53CYP3A4EPHX1
SCHEMBL1196119 0.86 TSHR (0.41) TSHRRAB9ATRPM8CYP3A4EPHX1
SCHEMBL234626 0.86 TP53 (0.48) TSHRRAB9ATP53CYP3A4EPHX1
SCHEMBL28559550 0.86 TP53 (0.48) TSHRRAB9ATP53CYP3A4EPHX1
SCHEMBL27296220 0.86 TSHR (0.43) TSHRRAB9ATP53CYP3A4HSP90AA1
SCHEMBL1170039 0.84 TP53 (0.47) TSHRRAB9ATP53CYP3A4EPHX1
SCHEMBL1296916 0.81 TSHR (0.41) TSHRRAB9ATP53CYP3A4ALDH1A1
SCHEMBL1196048 0.81 TRPM8 (0.43) TRPM8TP53CYP3A4ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2221320-B1 SOLID TITANIUM CATALYST INGREDIENT, CATALYST FOR OLEFIN POLYMERIZATION, AND METHOD OF POLYMERIZING OLEFIN MITSUI CHEMICALS INC (JP) 2017-06-21 EP disclosed
EP-1845113-B1 SOLID TITANIUM CATALYST COMPONENT, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER MITSUI CHEMICALS INC (JP) 2015-04-01 EP disclosed
US-8742040-B2 Solid titanium catalyst component, olefin polymerization catalyst, and olefin polymerization process MITSUI CHEMICALS, INC. (JP) 2014-06-03 US disclosed
US-8729189-B2 Propylene-based block copolymer, composition containing the copolymer, and molded products obtained therefrom MITSUI CHEMICALS, INC. (JP) 2014-05-20 US disclosed
US-20110172353-A1 PROPYLENE-BASED BLOCK COPOLYMER, COMPOSITION CONTAINING THE COPOLYMER, AND MOLDED PRODUCTS OBTAINED THEREFROM MITSUI CHEMICALS, INC. (JP) 2011-07-14 US disclosed
EP-2330139-A1 PROPYLENE-BASED BLOCK COPOLYMER AND COMPOSITION CONTAINING SAID COPOLYMER, AND MOLDED BODY OBTAINED THEREFROM Mitsui Chemicals, Inc. (JP) 2011-06-08 EP disclosed
US-7888438-B2 A solid titanium catalyst component comprising titanium, magnesium, halogen, and a C5-C10 carbocyclic diester, and an organometallic component; moldable polyolefins having broad molecular weight distribution MITSUI CHEMICALS, INC. (JP) 2011-02-15 US disclosed
US-20100305285-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND OLEFIN POLYMERIZATION PROCESS MITSUI CHEMICALS, INC. 2010-12-02 US disclosed
EP-2221320-A1 SOLID TITANIUM CATALYST INGREDIENT, CATALYST FOR OLEFIN POLYMERIZATION, AND METHOD OF POLYMERIZING OLEFIN Mitsui Chemicals, Inc. (JP) 2010-08-25 EP disclosed
US-7649062-B2 Solid titanium catalyst component, catalyst for polymerization of olefin and process for producing olefin polymer MITSUI CHEMICALS, INC. (JP) 2010-01-19 US disclosed
US-20090069515-A1 Solid Titanium Catalyst Component, Catalyst for Polymerization of Olefin and Process for Producing Olefin Polymer MITSUI CHEMICALS,INC. (JP) 2009-03-12 US disclosed
US-20080125555-A1 Catalyst for olefin polymerization and process for olefin polymerization MITSUI CHEMICALS, INC. (JP) 2008-05-29 US disclosed
US-20080097050-A1 Solid titanium catalyst component, catalyst for polymerization of olefin and process for producing olefin polymer MITSUI CHEMICALS, INC. (JP) 2008-04-24 US disclosed
EP-1845113-A1 SOLID TITANIUM CATALYST COMPONENT, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER Mitsui Chemicals, Inc. (JP) 2007-10-17 EP disclosed