SCHEMBL8095831

SCHEMBL8095831

CCC(C#N)CCC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.32
SLC15A2 Q16348 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL6356171 0.83 GABRP (0.41) ALDH1A1LMNA
SCHEMBL11143865 0.82 TSHR (0.31)
SCHEMBL10434717 0.81 TDP1 (0.36) TDP1
SCHEMBL27958764 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL8095838 0.78 MAPT (0.34)
SCHEMBL27676114 0.78 TSHR (0.44) ALDH1A1LMNA
SCHEMBL17260751 0.77
SCHEMBL6670794 0.77 AKR1B1 (0.43) ALDH1A1LMNATDP1
SCHEMBL27423467 0.76
SCHEMBL27604881 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6020488-A Small molecule inhibition of RNA/ligand binding SCRIPTGEN PHARMACEUTICALS INC. (US) 2000-02-01 US claimed
EP-0833824-A2 SMALL MOLECULE INHIBITION OF RNA/LIGAND BINDING SCRIPTGEN PHARMACEUTICALS, INC. (US) 1998-04-08 EP claimed
WO-1996040668-A2 SMALL MOLECULE INHIBITION OF RNA/LIGAND BINDING SCRIPTGEN PHARMACEUTICALS, INC. (US) 1996-12-19 WO claimed
US-6020488-A Small molecule inhibition of RNA/ligand binding SCRIPTGEN PHARMACEUTICALS INC. (US) 2000-02-01 US disclosed
EP-0833824-A2 SMALL MOLECULE INHIBITION OF RNA/LIGAND BINDING SCRIPTGEN PHARMACEUTICALS, INC. (US) 1998-04-08 EP disclosed
US-5668165-A TREATMENT OF HIV INFECTIONS SCRIPTGEN PHARMACEUTICALS, INC. (US) 1997-09-16 US disclosed
WO-1996040668-A2 SMALL MOLECULE INHIBITION OF RNA/LIGAND BINDING SCRIPTGEN PHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed