SCHEMBL3884352

SCHEMBL3884352

CC=CC(=O)OCCC(COP(=O)(O)O)[N+](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
PGD P52209 3/20 0.31
MPI P34949 1/20 0.31
ATM Q13315 1/20 0.30
GSTP1 P09211 1/20 0.30
LPAR6 P43657 1/20 0.30
LPAR1 Q92633 1/20 0.30
LPAR4 Q99677 1/20 0.30
LPAR5 Q9H1C0 1/20 0.30
LPAR2 Q9HBW0 1/20 0.30
LPAR3 Q9UBY5 1/20 0.30
ENPP2 Q13822 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
SCHEMBL3883030 1.00 PGK1 (0.33) PGK1PGK2PGDMPIATM
SCHEMBL541862 0.92 ATM (0.35) PGK1PGK2ATMLPAR6LPAR1
SCHEMBL20378001 0.91 ATM (0.34) ATMLPAR6LPAR1LPAR4LPAR5
SCHEMBL20505229 0.90 LPAR3 (0.31) ATMGSTP1LPAR1LPAR2LPAR3
SCHEMBL19614684 0.90 HCAR2 (0.35) ATMLPAR6LPAR1LPAR4LPAR5
SCHEMBL20378027 0.90 HCAR2 (0.35) ATMLPAR6LPAR1LPAR4LPAR5
SCHEMBL20378002 0.86 ATM (0.32) PGK1PGK2ATMLPAR6LPAR1
SCHEMBL20378040 0.86 PGK1 (0.31) PGK1PGK2
SCHEMBL20338139 0.84 TSHR (0.40) PGK1PGK2PGDMPILPAR6
SCHEMBL20378036 0.84 ATM (0.33) ATMLPAR6LPAR1LPAR4LPAR5

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 46 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-117980066-A Method for producing stationary phase for column chromatography 株式会社大赛璐 2024-05-03 CN claimed
CN-114502362-B Contact lenses with surfaces of different softness 爱尔康公司 2024-03-26 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
WO-2024135647-A1 COPOLYMER, AND COMPOSITION FOR EYES 日油株式会社 2024-06-27 WO disclosed
CN-118234766-A Polymer compound and use thereof 株式会社三养社 2024-06-21 CN disclosed
EP-4365669-A1 SOFT CONTACT LENS SOLUTION NOF Corporation (JP) 2024-05-08 EP disclosed
CN-117980066-A Method for producing stationary phase for column chromatography 株式会社大赛璐 2024-05-03 CN disclosed
CN-114080226-B Ophthalmic composition 爱尔康公司 2024-04-26 CN disclosed
CN-114502362-B Contact lenses with surfaces of different softness 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
EP-1245636-B1 COMPOSITION FOR HYDROGEL, HYDROGEL, AND USE THEREOF NOF CORP (JP) 2009-01-14 EP disclosed
US-6858673-B1 Composition for hydrogel, hydrogel and use thereof NOF CORPORATION (JP) 2005-02-22 US disclosed
US-6503632-B1 Siloxane polymers typified by polydimethylsiloxane have excellent biocompatibility, gas permeability, etc. alkylamide groups impart strength; medical equipment NOF CORPORATION (JP) 2003-01-07 US disclosed
EP-1245636-A1 COMPOSITION FOR HYDROGEL, HYDROGEL, AND USE THEREOF NOF CORPORATION (JP) 2002-10-02 EP disclosed
EP-1116740-A1 POLYDIALKYLSILOXANE / POLYAMIDE COPOLYMER, PROCESS FOR PRODUCING THE SAME, AND VARIOUS MATERIALS NOF CORPORATION (JP) 2001-07-18 EP disclosed
US-5977257-A Polymer material, medical material and liquid high molecular composition NOF CORPORATION (JP) 1999-11-02 US disclosed
EP-0823458-A1 POLYMERIC MATERIAL, MEDICAL MATERIAL AND LIQUID POLYMER COMPOSITION NOF CORPORATION (JP) 1998-02-11 EP disclosed