SCHEMBL6463900

SCHEMBL6463900

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

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.34
LPAR3 Q9UBY5 3/20 0.33
LPAR2 Q9HBW0 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
LPAR5 Q9H1C0 1/20 0.32
LPAR1 Q92633 2/20 0.31
PGD P52209 2/20 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
SCHEMBL22558167 0.90 LPAR3 (0.37) MPILPAR3LPAR2LPAR5LPAR1
SCHEMBL2321004 0.88 CDC25A (0.31)
SCHEMBL6469430 0.82 LPAR3 (0.35) MPILPAR3LPAR2PGK1PGK2
SCHEMBL20338139 0.81 TSHR (0.40) MPILPAR3LPAR2PGK1PGK2
SCHEMBL28529166 0.78 PGK1 (0.36) MPILPAR3LPAR2PGK1PGK2
SCHEMBL21293806 0.78 LPAR1 (0.33) MPILPAR3LPAR2PGK1PGK2
SCHEMBL6561764 0.75 LPAR5 (0.33) MPILPAR3PGK1PGK2LPAR5
SCHEMBL176509 0.75 TSHR (0.40) LPAR3LPAR2PGK1PGK2LPAR5
SCHEMBL28490589 0.75 LPAR5 (0.33) MPILPAR3PGK1PGK2LPAR5
SCHEMBL28642089 0.74 NPC1 (0.36) LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114080226-B Ophthalmic composition 爱尔康公司 2024-04-26 CN claimed
CN-114981072-B Wettable silicone hydrogel contact lenses 爱尔康公司 2024-03-26 CN claimed
CN-114502362-B Contact lenses with surfaces of different softness 爱尔康公司 2024-03-26 CN claimed
CN-115605529-B Photochromic polydiorganosiloxane vinyl cross-linking agent 爱尔康公司 2024-03-26 CN claimed
CN-117270235-A Contact lens having a lubricious coating thereon 爱尔康公司 2023-12-22 CN claimed
CN-111919141-B Silicone Hydrogel Contact Lenses 爱尔康公司 2023-11-14 CN claimed
CN-111566517-B Contact lens having a lubricious coating thereon 爱尔康公司 2023-11-10 CN claimed
CN-115605529-A Photochromic polydiorganosiloxane ethylene crosslinkers 爱尔康公司(CH) 2023-01-13 CN claimed
CN-115298574-A Embedded silicone hydrogel contact lenses 爱尔康公司 2022-11-04 CN claimed
CN-115298573-A High refractive index silicone insert materials for embedded contact lenses 爱尔康公司 2022-11-04 CN claimed
CN-114981072-A Wettable silicone hydrogel contact lenses 爱尔康公司 2022-08-30 CN claimed
CN-114727954-A Wet packed soft hydrogel ocular inserts 爱尔康公司 2022-07-08 CN claimed
CN-114502362-A Contact lenses with surfaces of varying softness 爱尔康公司 2022-05-13 CN claimed
CN-114080226-A Ophthalmic composition 爱尔康公司 2022-02-22 CN claimed
CN-111919141-A Silicone hydrogel contact lenses 爱尔康公司 2020-11-10 CN claimed
CN-111566517-A Contact lenses having lubricious coating thereon 爱尔康公司 2020-08-21 CN claimed
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
US-6858673-B1 Composition for hydrogel, hydrogel and use thereof NOF CORPORATION (JP) 2005-02-22 US disclosed
US-5977257-A Polymer material, medical material and liquid high molecular composition NOF CORPORATION (JP) 1999-11-02 US disclosed