SCHEMBL2858016

SCHEMBL2858016

CC1CC(CC(C(=O)O)C(=O)O)C(CC(C(=O)O)C(=O)O)C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.30
LMNA P02545 2/20 0.30
NPC1 O15118 2/20 0.30
ALDH1A1 P00352 2/20 0.30
NR2F2 P24468 2/20 0.30
RAB9A P51151 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
MAPK1 P28482 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
SLC2A1 P11166 1/20 0.30
EIF4A1 P60842 1/20 0.30
FKBP1A P62942 1/20 0.30
FKBP4 Q02790 1/20 0.30
EPAS1 Q99814 1/20 0.30
FKBP14 Q9NWM8 1/20 0.30
HTT P42858 1/20 0.30
SLC6A12 P48065 2/20 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
SCHEMBL2852618 0.87 EPHX1 (0.34)
SCHEMBL2851832 0.84 GRIN2D (0.34) CYP1A2
SCHEMBL2858972 0.79 EPHX2 (0.39)
SCHEMBL2861745 0.77 ALOX5 (0.32)
SCHEMBL2851535 0.74
SCHEMBL2854673 0.73
SCHEMBL2853914 0.71
SCHEMBL2856573 0.71 ALOX5 (0.43)
SCHEMBL2856389 0.71
SCHEMBL2859653 0.71 ALOX5 (0.43)

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
US-8822366-B2 Solid titanium catalyst component, catalyst for olefin polymerization and process for polymerizing olefin MITSUI CHEMICALS, INC. (JP) 2014-09-02 US disclosed
CN-102159608-B Propylene-based block copolymer and composition containing the copolymer, and molded body obtained therefrom MITSUI CHEMICALS INC 2014-05-21 CN disclosed
EP-2206731-B1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND OLEFIN POLYMERIZATION METHOD MITSUI CHEMICALS INC (JP) 2013-08-28 EP disclosed
US-20100227991-A1 SOLID TITANIUM CATALYST COMPONENT, CATALIST FOR OLEFIN POLYMERIZATION AND PROCESS FOR POLYMERIZING OLEFIN MITSUI CHEMICALS, INC. (JP) 2010-09-09 US disclosed
EP-2206731-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND OLEFIN POLYMERIZATION METHOD Mitsui Chemicals, Inc. (JP) 2010-07-14 EP disclosed