SCHEMBL2865047

SCHEMBL2865047

CCCCCCC1CCCC(C(C(=O)O)(C(=O)O)C(C)C)C1C(C(=O)O)(C(=O)O)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
TP53 P04637 1/20 0.36
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.33
S1PR3 Q99500 4/20 0.32
S1PR2 O95136 2/20 0.32
S1PR4 O95977 2/20 0.32
S1PR1 P21453 2/20 0.32
S1PR5 Q9H228 2/20 0.32
EPHX1 P07099 2/20 0.31
CTSK P43235 1/20 0.31
BCHE P06276 1/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARG P37231 1/20 0.30
NAAA Q02083 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
SCHEMBL2855823 0.92 ALOX5 (0.43) ALOX5TP53ALDH1A1POLBL3MBTL1
SCHEMBL2855697 0.86 ALOX5 (0.45) ALOX5TP53ALDH1A1POLBL3MBTL1
SCHEMBL2861693 0.80 ALOX5 (0.53) ALOX5TP53ALDH1A1POLBL3MBTL1
SCHEMBL2860540 0.75 DNTT (0.38) ALOX5TP53ALDH1A1MEN1KMT2A
SCHEMBL2861176 0.73 RECQL (0.33)
SCHEMBL2859880 0.72 TAS1R3 (0.31)
SCHEMBL5436849 0.69 ACE2 (0.56) ALOX5TP53MAPTMEN1KMT2A
SCHEMBL9618742 0.69 ALOX5 (0.45) ALOX5TP53S1PR3S1PR2S1PR4
SCHEMBL1925047 0.69 ALOX5 (0.51) ALOX5ALDH1A1S1PR3S1PR2S1PR4
SCHEMBL8997375 0.67 ALOX5 (0.50) ALOX5ALDH1A1MEN1KMT2APPARG

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