SCHEMBL438552

SCHEMBL438552

C=C(C)[CH]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
SCHEMBL7638573 0.73
SCHEMBL20818 0.71
SCHEMBL6751741 0.71
SCHEMBL433798 0.69
SCHEMBL875825 0.67
SCHEMBL11366817 0.67 TSHR (0.37)
SCHEMBL16288200 0.67
SCHEMBL4181756 0.67
SCHEMBL10167812 0.67
SCHEMBL17449672 0.67

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9603829-B2 HSP90 inhibitors with modified toxicity THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2017-03-28 US claimed
EP-2190291-B1 HSP90 INHIBITORS WITH MODIFIED TOXICITY UNIV COLORADO REGENTS (US) 2015-10-14 EP claimed
US-20140315845-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2014-10-23 US claimed
US-8551964-B2 Hsp90 inhibitors with modified toxicity THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2013-10-08 US claimed
WO-2013074695-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2013-05-23 WO claimed
US-20120022011-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2012-01-26 US claimed
EP-2190291-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY The Regents of the University of Colorado (US) 2010-06-02 EP claimed
US-7608611-B2 Hsp90 inhibitors, methods of making and uses therefor THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2009-10-27 US claimed
EP-1863769-A4 HSP90 INHIBITORS, METHODS OF MAKING AND USES THEREFOR UNIV COLORADO (US) 2009-03-18 EP claimed
WO-2009026548-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2009-02-26 WO claimed
EP-1863769-A2 HSP90 INHIBITORS, METHODS OF MAKING AND USES THEREFOR The Board of Regents of the University of Colorado (US) 2007-12-12 EP claimed
WO-2006098761-A2 HSP90 INHIBITORS, METHODS OF MAKING AND USES THEREFOR THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2006-09-21 WO claimed
US-20060205705-A1 Hsp90 inhibitors, methods of making and uses therefor UNIVERSITY OF COLORADO (US) 2006-09-14 US claimed
US-9603829-B2 HSP90 inhibitors with modified toxicity THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2017-03-28 US disclosed
EP-2190291-B1 HSP90 INHIBITORS WITH MODIFIED TOXICITY UNIV COLORADO REGENTS (US) 2015-10-14 EP disclosed
US-20140315845-A1 HSP90 INHIBITORS WITH MODIFIED TOXICITY THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2014-10-23 US disclosed
WO-1998038240-A1 COATED PLASTIC FILM FOR PRODUCING PACKAGING CONTAINERS PPG INDUSTRIES OHIO, INC. (US) 1998-09-03 WO disclosed
US-5180473-A Cationic Polymer Retention Aid MITSUI-CYANAMID, LTD. (JP) 1993-01-19 US disclosed
WO-1991003506-A1 PROCESS FOR GRAFTING OF NITROGEN-CONTAINING POLYMERS, AND POLYMERS THUS OBTAINED SARTORIUS AG (DE) 1991-03-21 WO disclosed
EP-0256500-A2 Emulsion polymers containing acrylonitrile or vinylidene chloride THE GLIDDEN COMPANY (US) 1988-02-24 EP disclosed