SCHEMBL9906789

SCHEMBL9906789

COC(=O)C(C)(Br)CC(C)(C)C(=O)OCCSSCCOC(=O)C(C)(C)CC(C)(Br)C(=O)ON1C(=O)CCC1=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
SCHEMBL9906813 0.90
SCHEMBL13989229 0.85 ALDH1A1 (0.33)
SCHEMBL9906793 0.84
SCHEMBL9906796 0.82
SCHEMBL9906790 0.80 LMNA (0.32)
SCHEMBL12695655 0.80 MEN1 (0.33)
SCHEMBL13989221 0.80 HPGD (0.32)
SCHEMBL9906794 0.75 MEN1 (0.30)
SCHEMBL13779184 0.74 SMN1; SMN2 (0.34)
SCHEMBL21861777 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546488-B2 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation UNIVERSITY OF MASSACHUSETTS (US) 2013-10-01 US disclosed
US-20120245244-A1 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation NATIONAL SCIENCE FOUNDATION 2012-09-27 US disclosed
US-8198368-B2 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation UNIVERSITY OF MASSACHUSETTS (US) 2012-06-12 US disclosed
US-20090105427-A1 Cleavable Block Copolymers, Functionalized Nanoporous Thin Films and Related Methods of Preparation UNIVERSITY OF MASSACHUSETTS 2009-04-23 US disclosed