SCHEMBL2858732

SCHEMBL2858732

CC1CCCC(CCC(C(=O)O)C(=O)O)C1CCC(C(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.33
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

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
SCHEMBL2857696 0.97 GRIN2D (0.33) HMGCR
SCHEMBL2857741 0.90 HMGCR (0.34) HMGCRPTGS1PTGS2MT-CO1MT-CO2
SCHEMBL2861218 0.89 HMGCR (0.37) HMGCR
SCHEMBL2858822 0.89 EPHX1 (0.32) HMGCR
SCHEMBL2851373 0.87 HMGCR (0.40) HMGCR
SCHEMBL2854082 0.87 PTGS1 (0.30) PTGS1PTGS2MT-CO1MT-CO2
SCHEMBL2855820 0.84 TBXA2R (0.32)
SCHEMBL2865061 0.84 TBXA2R (0.32)
SCHEMBL2861178 0.84 TBXA2R (0.32)
SCHEMBL2862677 0.84 TBXA2R (0.32)

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