SCHEMBL4414813

SCHEMBL4414813

[C]#CC#Cc1[c]cccc1

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
SCHEMBL185154 0.77
SCHEMBL483062 0.73
SCHEMBL16289085 0.73
SCHEMBL4794388 0.73
SCHEMBL1378978 0.72
SCHEMBL1822569 0.71 APP (0.55)
SCHEMBL2649459 0.70 ALDH1A1 (0.36)
SCHEMBL483300 0.68 KDM4E (0.34)
SCHEMBL22759 0.68 KDM4E (0.32)
SCHEMBL2993 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2130908-A2 Retinoid compounds and their use REINNERVATE LIMITED (GB) 2009-12-09 EP claimed
US-9694344-B2 Multilayer polymeric membrane and process LiSo Plastics, L.L.C. (US) 2017-07-04 US disclosed
US-20160243525-A1 Multilayer Polymeric Membrane and Process LiSo Plastics, L.L.C. (US) 2016-08-25 US disclosed
US-8956876-B2 Method for quantitatively detecting 8-OXO 2′-deoxyguanosine in aqueous sample solution with high sensitivity TAS Project Co. Ltd (JP) 2015-02-17 US disclosed
US-20140057357-A1 METHOD FOR QUANTITATIVELY DETECTING 8-OXO 2'-DEOXYGUANOSINE IN AQUEOUS SAMPLE SOLUTION WITH HIGH SENSITIVITY TAS Project Co. Ltd. (JP) 2014-02-27 US disclosed
EP-2690429-A1 METHOD FOR QUANTITATIVELY DETECTING 8-OXO-2'-DEOXYGUANOSINE IN AQUEOUS SAMPLE SOLUTION WITH HIGH SENSITIVITY TAS Project Co. Ltd. (JP) 2014-01-29 EP disclosed