SCHEMBL4886760

SCHEMBL4886760

C=CCN(CC=C)C(CC)=C(C)C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
DPP4 P27487 1/20 0.33
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.31
F2 P00734 2/20 0.31
KLK1 P06870 2/20 0.31
PRSS1 P07477 2/20 0.31
SLC6A2 P23975 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SLC6A4 P31645 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1276104 1.00 ALDH1A1 (0.38) ALDH1A1DPP4MAPTTSHRF2
SCHEMBL1275243 0.86 ALDH1A1 (0.40) ALDH1A1DPP4MAPTTSHR
SCHEMBL17273521 0.86 ALDH1A1 (0.40) ALDH1A1DPP4MAPTTSHR
SCHEMBL2448134 0.85 ALDH1A1 (0.38) ALDH1A1DPP4SMN1; SMN2TDP1
SCHEMBL500684 0.85 ALDH1A1 (0.38) ALDH1A1DPP4SMN1; SMN2TDP1
SCHEMBL6472141 0.83 ALDH1A1 (0.39) ALDH1A1DPP4MAPTTSHRSLC6A2
SCHEMBL1275894 0.83 ALDH1A1 (0.39) ALDH1A1DPP4MAPTTSHRSLC6A2
SCHEMBL6519104 0.78 LMNA (0.34) ALDH1A1TDP1
SCHEMBL894269 0.78 LMNA (0.34) ALDH1A1TDP1
SCHEMBL6260806 0.75 CA12 (0.40) ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US claimed
US-7144946-B2 Cationic polyvinyl alcohol-containing compositions Smith, Hugh McIntyre (US) 2006-12-05 US disclosed
US-20040122151-A1 Cationic polyvinyl alcohol-containing compositions SMITH HUGH MCINTYRE 2004-06-24 US disclosed