SCHEMBL13519367

SCHEMBL13519367

CCCCC(C)=C(C(=O)O)C(CCCC)(CC(C)C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
CES1 P23141 1/20 0.31

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
SCHEMBL13519448 0.96 THRB (0.35) ALDH1A1
SCHEMBL13519355 0.84 ALDH1A1 (0.31) ALDH1A1TP53
SCHEMBL6158271 0.81 AKR1B1 (0.33) ALDH1A1
SCHEMBL13269058 0.80
SCHEMBL27814491 0.79 ACE2 (0.31)
SCHEMBL13517557 0.76 ALDH1A1 (0.33) ALDH1A1TP53CES1
SCHEMBL13517767 0.73 ALDH1A1 (0.38) ALDH1A1
SCHEMBL13269386 0.73
SCHEMBL28377214 0.71 FNTA (0.42) ALDH1A1TP53CES1
SCHEMBL13519436 0.71 EP300 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394734-B2 Solid catalyst for propylene polymerization and a method for preparation of polypropylene using the same SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2013-03-12 US disclosed
US-20120277389-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND A METHOD FOR PREPARATION OF POLYPROPYLENE USING THE SAME SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2012-11-01 US disclosed