SCHEMBL2858170

SCHEMBL2858170

CC(C)C(C(=O)O)(C(=O)O)C1CCCCC(C(C(=O)O)(C(=O)O)C(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2857804 0.96 KEAP1 (0.32) KEAP1NFE2L2
SCHEMBL2861725 0.91 GRM2 (0.31)
SCHEMBL28004680 0.91 KEAP1 (0.37) KEAP1NFE2L2ALDH1A1SMN1; SMN2
SCHEMBL28004203 0.89 KEAP1 (0.36) KEAP1NFE2L2
SCHEMBL28315722 0.88 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL21269988 0.88 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL21269474 0.88 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL21269676 0.88 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL28314487 0.88 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL28315925 0.88 KEAP1 (0.35) KEAP1NFE2L2

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