SCHEMBL2734258

SCHEMBL2734258

CNCCNCC(C)=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
SCHEMBL26950116 0.86 PAOX (0.38)
SCHEMBL25668219 0.84 GAA (0.31)
SCHEMBL23428769 0.83 PAOX (0.44)
SCHEMBL11709983 0.79
SCHEMBL13225487 0.79 LMNA (0.43)
SCHEMBL8851248 0.79 CYP2C19 (0.39)
SCHEMBL9414616 0.78 PAOX (0.41)
SCHEMBL12226422 0.77 KDM4E (0.50)
SCHEMBL24084024 0.77 ALDH1A1 (0.30)
SCHEMBL22821625 0.77 LMNA (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023086467-A1 CELASTROL PROTEOLYSIS TARGETING CHIMERAS THE GENERAL HOSPITAL CORPORATION (US) 2023-05-19 WO disclosed
US-11078235-B2 Cyclic peptide conjugates and methods of use H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2021-08-03 US disclosed
US-20190092812-A1 CYCLIC PEPTIDE CONJUGATES AND METHODS OF USE UNIVERSITY OF FLORIDA REASEARCH FOUNDATION INCORPORATED 2019-03-28 US disclosed
US-10011635-B2 Cyclic peptide conjugates and methods of use H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2018-07-03 US disclosed
US-20160251470-A1 ZWITTERIONIC POLYSACCHARIDE POLYMERS HAVING ANTIFOULING, ANTIMICROBIAL AND OPTICAL TRANSPARENCY PROPERTIES NATIONAL SCIENCE FOUNDATION 2016-09-01 US disclosed
WO-2013051625-A1 METHOD FOR PRODUCING MEGAKARYOCYTES AND/OR PLATELETS FROM PLURIPOTENT STEM CELLS 日産化学工業株式会社 (JP) 2013-04-11 WO disclosed
EP-1957482-B1 QUINAZOLINES USEFUL AS MODULATORS OF VOLTAGE GATED ION CHANNELS VERTEX PHARMA (US) 2012-01-04 EP disclosed
WO-2010140685-A1 HETEROCYCLIC COMPOUND AND HEMATOPOIETIC STEM CELL AMPLIFIER 日産化学工業株式会社 (JP) 2010-12-09 WO disclosed
EP-1944300-A2 Prodrugs of aspartyl protease inhibitors Vertex Pharmaceuticals Incorporated (US) 2008-07-16 EP disclosed
CN-1053472-C Oligonucleotides derived from the SOD family HOFFMANN LA ROCHE (CH) 2000-06-14 CN disclosed
US-5618814-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds DR. KARL THOMAE GMBH (DE) 1997-04-08 US disclosed
CN-1106405-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating THOMAE GMBH DR K (DE) 1995-08-09 CN disclosed