SCHEMBL1908163

SCHEMBL1908163

[CH2]CCC#CC#CCC[CH2]

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
SCHEMBL20721890 0.96
SCHEMBL8769471 0.89
SCHEMBL5986206 0.87
SCHEMBL4500421 0.84
SCHEMBL16288850 0.84
SCHEMBL3923587 0.82
SCHEMBL8769470 0.82
SCHEMBL693375 0.79
SCHEMBL16287908 0.79
SCHEMBL270841 0.79

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
EP-2784076-A1 Dimeric SMAC mimetics Joyant Pharmaceuticals, Inc. (US) 2014-10-01 EP disclosed
EP-2493879-B1 DIMERIC SMAC MIMETICS JOYANT PHARMACEUTICALS INC (US) 2014-05-14 EP disclosed
US-20140127155-A1 Smac mimetic dimers and trimers useful as anti-cancer agents JOYANT PHARMACEUTICALS, INC (US) 2014-05-08 US disclosed
US-8642554-B2 Smac mimetic dimers and trimers useful as anti-cancer agents JOYANT PHARMACEUTICALS, INC. (US) 2014-02-04 US disclosed
US-20130344026-A1 Dimeric Smac Mimetics JOYANT PHARMACEUTICALS, INC. 2013-12-26 US disclosed
US-8551955-B2 Dimeric Smac mimetics JOYANT PHARMACEUTICALS, INC. (US) 2013-10-08 US disclosed
EP-2493879-A2 DIMERIC SMAC MIMETICS Joyant Pharmaceuticals, Inc. (US) 2012-09-05 EP disclosed
US-20110195043-A1 Dimeric Smac Mimetics JOYANT PHARMACEUTICALS, INC. 2011-08-11 US disclosed
WO-2011059763-A2 DIMERIC SMAC MIMETICS JOYANT PHARMACEUTICALS, INC. (US) 2011-05-19 WO disclosed
EP-2079309-A1 SMAC MIMETIC DIMERS AND TRIMERS USEFUL AS ANTI-CANCER AGENTS Joyant Pharmaceuticals, Inc. (US) 2009-07-22 EP disclosed
US-20090104151-A1 SMAC MIMETIC DIMERS AND TRIMERS USEFUL AS ANTI-CANCER AGENTS JOYANT PHARMACEUTICALS, INC (US) 2009-04-23 US disclosed
WO-2008128121-A1 SMAC MIMETIC DIMERS AND TRIMERS USEFUL AS ANTI-CANCER AGENTS JOYANT PHARMACEUTICALS, INC. (US) 2008-10-23 WO disclosed