SCHEMBL2854415

SCHEMBL2854415

CC(C)C(C(=O)O)(C(=O)O)C1CCCCC1C(C(=O)O)(C(=O)O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KLK7 P49862 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
EPHX1 P07099 2/20 0.31
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 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
SCHEMBL2855828 0.98 EPHX1 (0.33) KEAP1NFE2L2KLK7CYP1A2CYP2D6
SCHEMBL2861176 0.95 RECQL (0.33) CYP1A2CYP2D6GRM2GRM3
SCHEMBL2859860 0.83 EPHX1 (0.31) EPHX1
SCHEMBL28004680 0.82 KEAP1 (0.37) KEAP1NFE2L2ALDH1A1SMN1; SMN2TAS1R3
SCHEMBL28004203 0.80 KEAP1 (0.36) KEAP1NFE2L2EPHX1
SCHEMBL2859880 0.79 TAS1R3 (0.31) TAS1R3TAS1R1
SCHEMBL2858170 0.78 KEAP1 (0.35) KEAP1NFE2L2ALDH1A1SMN1; SMN2
SCHEMBL21269676 0.78 KEAP1 (0.35) KEAP1NFE2L2EPHX1
SCHEMBL21269988 0.78 KEAP1 (0.35) KEAP1NFE2L2EPHX1
SCHEMBL21269474 0.78 KEAP1 (0.35) KEAP1NFE2L2EPHX1

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
CN-107406543-A Polypropylene resin composite and its manufacture method, biaxially-stretched film and its manufacture method and thin film capacitor electricity container film 普瑞曼聚合物株式会社 2017-11-28 CN disclosed
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