SCHEMBL4596839

SCHEMBL4596839

C=C(C)C(=O)C(O)C(C)(C)C(=O)OCC(C)(C)CO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL30096986 0.78 PRKCA (0.32)
SCHEMBL1644815 0.73
Methacrylic Acid SCHEMBL6737902 0.72 CYP4F2 (0.31)
SCHEMBL27278 0.72 TSHR (0.45)
SCHEMBL5692427 0.71 ALDH1A1 (0.42)
SCHEMBL472433 0.71 TSHR (0.38)
SCHEMBL3682794 0.70 ALDH1A1 (0.32)
SCHEMBL2865477 0.70
SCHEMBL9348634 0.69 PRKCA (0.44)
SCHEMBL19433445 0.68 TSHR (0.41)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699953-B2 A COPOLYMER OBTAINED BY COPOLYMERIZING MONOMERS CONTAINING 20 TO 80% BY WEIGHT OF BIS-2-METHACRYLOYLTHIOETHYL SULFIDE, 5-50% A BI OR MULTIFUNCTIONAL THIOL AND HAS A REFRACTIVE INDEX OF 1.58 OR MORE, AND AN ABBE'S NUMBER OF 35 OR MORE SEED CO., LTD. (JP) 2004-03-02 US claimed
US-20030130461-A1 Lens made f synthetic resin and process for producing the same SEED CO., LTD. (JP) 2003-07-10 US claimed
EP-1316820-A1 LENS MADE OF SYNTHETIC RESIN AND PROCESS FOR PRODUCING THE SAME Seed Co., Ltd. (JP) 2003-06-04 EP claimed
EP-1316820-B1 LENS MADE OF SYNTHETIC RESIN AND PROCESS FOR PRODUCING THE SAME SEED CO LTD (JP) 2008-01-16 EP disclosed
US-6699953-B2 A COPOLYMER OBTAINED BY COPOLYMERIZING MONOMERS CONTAINING 20 TO 80% BY WEIGHT OF BIS-2-METHACRYLOYLTHIOETHYL SULFIDE, 5-50% A BI OR MULTIFUNCTIONAL THIOL AND HAS A REFRACTIVE INDEX OF 1.58 OR MORE, AND AN ABBE'S NUMBER OF 35 OR MORE SEED CO., LTD. (JP) 2004-03-02 US disclosed
US-20030130461-A1 Lens made f synthetic resin and process for producing the same SEED CO., LTD. (JP) 2003-07-10 US disclosed
EP-1316820-A1 LENS MADE OF SYNTHETIC RESIN AND PROCESS FOR PRODUCING THE SAME Seed Co., Ltd. (JP) 2003-06-04 EP disclosed