SCHEMBL9364273

SCHEMBL9364273

O=[C]OCC1SCCCS1

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
SCHEMBL7351888 0.74
SCHEMBL1455759 0.68
SCHEMBL161562 0.65 ALOX15 (0.34)
SCHEMBL3870884 0.64
SCHEMBL26622053 0.64 LMNA (0.32)
SCHEMBL6570617 0.64
SCHEMBL317020 0.64
SCHEMBL457301 0.64
SCHEMBL9670422 0.63
SCHEMBL133080 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220056002-A1 PHOTOCLEAVABLE LINKER FOR CATCHING AND/OR RELEASING OF CIRCULATING TUMOR CELLS OR EXTRA CELLULAR VESICLES THE UNIVERSITY OF KANSAS (US) 2022-02-24 US claimed
EP-3053944-B1 METHOD FOR PRODUCING POLYALKYLENE GLYCOL DERIVATIVE HAVING AMINO GROUP AT END, POLYMERIZATION INITIATOR FOR USE IN THE SAME, AND ALCOHOL COMPOUND AS RAW MATERIAL FOR THE POLYMERIZATION INITIATOR SHINETSU CHEMICAL CO (JP) 2021-10-06 EP claimed
WO-2020132618-A1 PHOTOCLEAVABLE LINKER FOR CATCHING AND/OR RELEASING OF CIRCULATING TUMOR CELLS OR EXTRACELLULAR VESICLES THE UNIVERSITY OF KANSAS (US) 2020-06-25 WO claimed
EP-0292806-B1 Substituted vinyl cephalosporins, process for their preparation and their use as medicines BAYER AG (DE) 1994-11-02 EP claimed
EP-0292806-A2 Substituted vinyl cephalosporins, process for their preparation and their use as medicines BAYER AG (DE) 1988-11-30 EP claimed
US-20220056002-A1 PHOTOCLEAVABLE LINKER FOR CATCHING AND/OR RELEASING OF CIRCULATING TUMOR CELLS OR EXTRA CELLULAR VESICLES THE UNIVERSITY OF KANSAS (US) 2022-02-24 US disclosed
WO-2020132618-A1 PHOTOCLEAVABLE LINKER FOR CATCHING AND/OR RELEASING OF CIRCULATING TUMOR CELLS OR EXTRACELLULAR VESICLES THE UNIVERSITY OF KANSAS (US) 2020-06-25 WO disclosed
EP-0292806-B1 Substituted vinyl cephalosporins, process for their preparation and their use as medicines BAYER AG (DE) 1994-11-02 EP disclosed
EP-0296374-B1 GLYCOSYLATED AMINOACIDS AND PEPTIDES HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-07 EP disclosed
US-5171854-A Antibiotics BAYER AKTIENGESELLSCHAFT (DE) 1992-12-15 US disclosed
EP-0296374-A2 Glycosylated aminoacids and peptides HOECHST AKTIENGESELLSCHAFT (DE) 1988-12-28 EP disclosed