SCHEMBL498084

SCHEMBL498084

C=CCSC1C[CH]CC1

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
SCHEMBL14659491 0.76
SCHEMBL8643693 0.75 ALDH1A1 (0.38)
SCHEMBL19284903 0.72
SCHEMBL9614575 0.72 TRPA1 (0.36)
SCHEMBL1110622 0.72
SCHEMBL1110579 0.70 TRPA1 (0.35)
SCHEMBL9614514 0.68 TRPA1 (0.33)
SCHEMBL2769573 0.65
SCHEMBL21047748 0.64
SCHEMBL11105581 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106032-B2 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2012-01-31 US disclosed
US-20080293667-A1 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2008-11-27 US disclosed
EP-0781138-B1 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS UNIV WAKE FOREST (US) 2008-05-21 EP disclosed
US-7294621-B2 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
US-7294620-B2 Lipid analogs for inhibiting HIV-1 activity WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
US-7294619-B2 Lipid analogs for inhibiting the activity of hepatitis B antigen WAKE FOREST UNIVERSITY (US) 2007-11-13 US disclosed
EP-1852121-A2 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2007-11-07 EP disclosed
US-20070105812-A1 Lipid analogs for inhibiting HIV-1 activity WAKE FOREST UNIVERSITY 2007-05-10 US disclosed
US-20070105811-A1 Lipid analogs for inhibiting the activity of hepatitis B antigen WAKE FOREST UNIVERSITY 2007-05-10 US disclosed
US-20070099870-A1 Lipid analogs for combating tumors WAKE FOREST UNIVERSITY 2007-05-03 US disclosed
US-7141557-B2 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2006-11-28 US disclosed
US-7135584-B2 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2006-11-14 US disclosed
US-7129227-B1 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2006-10-31 US disclosed
US-20050080050-A1 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY (US) 2005-04-14 US disclosed
US-20040259845-A1 Lipid analogs for treating viral infections WAKE FOREST UNIVERSITY 2004-12-23 US disclosed
US-5962437-A HEPATITIS, HERPES AND AIDA VIRUS WAKE FOREST UNIVERSITY (US) 1999-10-05 US disclosed
EP-0781138-A2 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS WAKE FOREST UNIVERSITY (US) 1997-07-02 EP disclosed
WO-1996006620-A2 LIPID ANALOGS FOR TREATING VIRAL INFECTIONS WAKE FOREST UNIVERSITY (US) 1996-03-07 WO disclosed