SCHEMBL4890349

SCHEMBL4890349

CCC(CCCO)CC(CC)C(C)O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.33
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
SCHEMBL18951918 0.81 LMNA (0.39) ALDH1A1LMNATDP1
SCHEMBL28272544 0.79 ALDH1A1 (0.44) ALDH1A1LMNATDP1
SCHEMBL8607642 0.79 ALDH1A1 (0.44) ALDH1A1LMNATDP1
SCHEMBL28340607 0.79 TRPA1 (0.42) ALDH1A1LMNATDP1
SCHEMBL27809448 0.77 ALDH1A1 (0.43) ALDH1A1LMNATDP1
SCHEMBL4880627 0.76 ALDH1A1 (0.46) ALDH1A1LMNATDP1
SCHEMBL4889313 0.76 ALDH1A1 (0.39) ALDH1A1LMNATDP1
SCHEMBL9173076 0.75 ALDH1A1 (0.55) ALDH1A1LMNATDP1
SCHEMBL1038859 0.75
SCHEMBL9724865 0.74 ALDH1A1 (0.38) ALDH1A1

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
US-20080293880-A1 Liquid, Thermally Curable Mixtures, Their Preparation and Use BASF COATINGS AG (DE) 2008-11-27 US claimed