SCHEMBL6052020

SCHEMBL6052020

CCCC(=O)N1CSCC1OC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.33
DPP4 P27487 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
CHRNB3 Q05901 1/20 0.33
CHRNA6 Q15825 1/20 0.33

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
SCHEMBL6051966 0.87 ACE (0.35) ACEDPP4
SCHEMBL9362245 0.81 ACE (0.32) ACE
SCHEMBL7268458 0.79 PREP (0.37) ACEDPP4
SCHEMBL2525637 0.78 ACE (0.34) ACEDPP4
SCHEMBL6052009 0.76 ACE (0.53) ACEDPP4CHRNB2CHRNA3CHRNA4
SCHEMBL9878022 0.72 ATM (0.39)
SCHEMBL10783221 0.72 DPP4 (0.42) ACEDPP4
SCHEMBL11384419 0.72 ACE (0.63) ACE
SCHEMBL10926791 0.72 ACE (0.63) ACE
SCHEMBL10865225 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487271-B1 COMPOSITIONS WITH A BIOSTIMULATING ACTIVITY ISAGRO SPA (IT) 2006-08-30 EP claimed