SCHEMBL2859616

SCHEMBL2859616

CC1CCCC(CCC(C(=O)O)C(=O)O)C(CCC(C(=O)O)C(=O)O)C1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.33
GRIN2D O15399 5/20 0.33
GRIN3B O60391 5/20 0.33
GRIN1 Q05586 5/20 0.33
GRIN2A Q12879 5/20 0.33
GRIN2B Q13224 5/20 0.33
GRIN2C Q14957 5/20 0.33
GRIN3A Q8TCU5 5/20 0.33
CPB2 Q96IY4 2/20 0.32
PTGS1 P23219 7/20 0.31
PTGS2 P35354 6/20 0.31
MT-CO1 P00395 1/20 0.31
MT-CO2 P00403 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 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
SCHEMBL2851526 0.89 EPHX1 (0.33)
SCHEMBL2859646 0.87 ALOX5 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2856386 0.87 ALOX5 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2861745 0.85 ALOX5 (0.32)
SCHEMBL2859871 0.85 GRIN2D (0.40) HMGCRGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2861029 0.81 GRIN2D (0.43) HMGCRGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2856809 0.79 ALOX5 (0.34)
SCHEMBL2857796 0.79 GRIN2D (0.42) HMGCRGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2851832 0.79 GRIN2D (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2858991 0.77 ALOX5 (0.39)

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 4 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
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