SCHEMBL13907321

SCHEMBL13907321

CC(C)[C@H](NCl)C(=O)O

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
SCHEMBL13577927 1.00
SCHEMBL3380324 0.81
SCHEMBL3380321 0.81
SCHEMBL8704714 0.81
SCHEMBL16329510 0.78
SCHEMBL18831867 0.78
SCHEMBL2633071 0.76
SCHEMBL10210476 0.76
SCHEMBL13948170 0.76
SCHEMBL3874820 0.75 ALDH1A1 (0.57)

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-20240091121-A1 PHOSPHONATES AND N-HALAMINES COMPOSITIONS FOR TARTAR REMOVAL O.Y.M. INNOVATION LTD. (IL) 2024-03-21 US disclosed
EP-4274539-A2 PHOSPHONATES AND N-HALAMINES COMPOSITIONS FOR TARTAR REMOVAL O.Y.M. Innovation Ltd. (IL) 2023-11-15 EP disclosed
CN-116710046-A Phosphonic acid and N-halamine compositions for tartar removal O.Y.M.创新有限公司 2023-09-05 CN disclosed
WO-2022149126-A2 PHOSPHONATES AND N-HALAMINES COMPOSITIONS FOR TARTAR REMOVAL O.Y.M. INNOVATION LTD. (IL) 2022-07-14 WO disclosed
WO-2009037172-A1 PRODRUGS TO THYROID HORMONE ANALOGS F. HOFFMANN-LA ROCHE AG (CH) 2009-03-26 WO disclosed
WO-2008043704-A1 HCV NUCLEOSIDE INHIBITOR MEDIVIR AB (SE) 2008-04-17 WO disclosed
US-7265140-B2 Acyloxymethylcarbamate prodrugs of oxazolidinones PFIZER INC (US) 2007-09-04 US disclosed