SCHEMBL6469430

SCHEMBL6469430

C=CCOCCC(COP(=O)(O)O)[N+](C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.35
LPAR2 Q9HBW0 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
LPAR5 Q9H1C0 1/20 0.33
LPAR1 Q92633 2/20 0.33
MPI P34949 1/20 0.33
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 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
SCHEMBL2321686 0.89 TDP1 (0.33) TDP1
SCHEMBL6561764 0.84 LPAR5 (0.33) LPAR3LPAR5LPAR1MPIPGK1
SCHEMBL28490589 0.84 LPAR5 (0.33) LPAR3LPAR5LPAR1MPIPGK1
SCHEMBL6463900 0.82 MPI (0.34) LPAR3LPAR2LPAR5LPAR1MPI
SCHEMBL28460459 0.79 TSHR (0.40) LPAR3LPAR2TDP1LPAR5LPAR1
SCHEMBL20338139 0.78 TSHR (0.40) LPAR3LPAR2LPAR5LPAR1MPI
SCHEMBL19971901 0.76 S1PR2 (0.32) LPAR3LPAR2TDP1
SCHEMBL28651132 0.76 S1PR2 (0.33) LPAR5
SCHEMBL28529166 0.76 PGK1 (0.36) LPAR3LPAR2LPAR5LPAR1MPI
SCHEMBL21293806 0.75 LPAR1 (0.33) LPAR3LPAR2LPAR5LPAR1MPI

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118234766-A Polymer compound and use thereof 株式会社三养社 2024-06-21 CN claimed
CN-114080226-B Ophthalmic composition 爱尔康公司 2024-04-26 CN claimed
CN-117270235-A Contact lens having a lubricious coating thereon 爱尔康公司 2023-12-22 CN claimed
CN-111566517-B Contact lens having a lubricious coating thereon 爱尔康公司 2023-11-10 CN claimed
CN-115298574-A Embedded silicone hydrogel contact lenses 爱尔康公司 2022-11-04 CN claimed
CN-111919141-A Silicone hydrogel contact lenses 爱尔康公司 2020-11-10 CN claimed
CN-118234766-A Polymer compound and use thereof 株式会社三养社 2024-06-21 CN disclosed
CN-114080226-B Ophthalmic composition 爱尔康公司 2024-04-26 CN disclosed
CN-114981072-B Wettable silicone hydrogel contact lenses 爱尔康公司 2024-03-26 CN disclosed
CN-117716262-A Method for producing wettable silicone hydrogel contact lenses 爱尔康公司 2024-03-15 CN disclosed
CN-117270235-A Contact lens having a lubricious coating thereon 爱尔康公司 2023-12-22 CN disclosed
CN-117280252-A Multifocal diffractive silicone hydrogel contact lenses 爱尔康公司 2023-12-22 CN disclosed
CN-111919141-B Silicone Hydrogel Contact Lenses 爱尔康公司 2023-11-14 CN disclosed
CN-116888193-A Polysiloxane vinyl cross-linking agent with high refractive index 爱尔康公司 2023-10-13 CN disclosed
CN-115298574-A Embedded silicone hydrogel contact lenses 爱尔康公司 2022-11-04 CN disclosed
CN-115298573-A High refractive index silicone insert materials for embedded contact lenses 爱尔康公司 2022-11-04 CN disclosed
CN-114727954-A Wet packed soft hydrogel ocular inserts 爱尔康公司 2022-07-08 CN disclosed
CN-108463493-B Polymeric substrate having a surface with reduced biomolecule adhesion and thermoplastic articles of such substrate SIO2医药产品公司 2021-10-15 CN disclosed
EP-3377565-A1 POLYMERIC SUBSTRATE WITH A SURFACE HAVING REDUCED BIOMOLECULE ADHESION, AND THERMOPLASTIC ARTICLES OF SUCH SUBSTRATE SiO2 Medical Products, Inc. (US) 2018-09-26 EP disclosed
US-6858673-B1 Composition for hydrogel, hydrogel and use thereof NOF CORPORATION (JP) 2005-02-22 US disclosed