SCHEMBL3206420

SCHEMBL3206420

CCCCC(CC)C(O)CCC(C)CC(O)CC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
SPHK1 Q9NYA1 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ACE2 Q9BYF1 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
SCHEMBL10943461 0.83 LMNA (0.40) LMNASPHK1ALDH1A1
SCHEMBL26100730 0.82 ALDH1A1 (0.39) SPHK1ALDH1A1ACE2
SCHEMBL11209328 0.77 LMNA (0.37) LMNASPHK1ALDH1A1
SCHEMBL26103818 0.77 ACE2 (0.44) LMNASPHK1ACE2
SCHEMBL811914 0.76 LMNA (0.62) LMNASPHK1ALDH1A1
SCHEMBL26598033 0.76 LMNA (0.44) LMNASPHK1ALDH1A1
SCHEMBL14125763 0.74 SPHK1 (0.50) LMNASPHK1ALDH1A1
SCHEMBL9136335 0.74 TSHR (0.48) LMNA
SCHEMBL2396809 0.74 LMNA (0.46) LMNASPHK1ALDH1A1
SCHEMBL28867445 0.73 ACE2 (0.50) LMNASPHK1ACE2

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-7682460-B2 Cleaning method FERRARA MARCELLO 2010-03-23 US claimed