SCHEMBL8102360

SCHEMBL8102360

CC(C)CCCCC(O[C](OC(CCCCC(C)C)C(=O)O)OC(CCCCC(C)C)C(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.48
FOLH1 Q04609 6/20 0.39
ACE2 Q9BYF1 1/20 0.37
CA1 P00915 2/20 0.36
LTA4H P09960 1/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM4A O75164 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
RARB P10826 1/20 0.36
LMNA P02545 1/20 0.36
GABRR1 P24046 2/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL28023430 0.86 BLM (0.42) BLMFOLH1KDM4CKDM4APHF8
SCHEMBL28022738 0.84 TRPV1 (0.43) BLMFOLH1ACE2KDM4CKDM4A
SCHEMBL28022742 0.84 TRPV1 (0.43) BLMFOLH1ACE2KDM4CKDM4A
SCHEMBL28183601 0.82 BLM (0.40) BLMFOLH1ACE2CA1KDM4C
SCHEMBL28023377 0.81 BLM (0.39) BLMFOLH1ACE2KDM4CKDM4A
SCHEMBL28820895 0.81 BLM (0.39) BLMFOLH1ACE2KDM4CKDM4A
SCHEMBL5915125 0.79 BLM (0.44) BLMACE2KDM4CKDM4APHF8
SCHEMBL2550058 0.79 BLM (0.44) BLMACE2KDM4CKDM4APHF8
SCHEMBL10828911 0.78 BLM (0.42) BLMLTA4HKDM4CKDM4APHF8
SCHEMBL4949359 0.76 BLM (0.41) BLMACE2CA1KDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150322236-A1 PVC COMPOSITIONS OF HIGH IMPACT STRENGTH BASF SE (DE) 2015-11-12 US disclosed
EP-2814884-A1 PVC COMPOSITIONS OF HIGH IMPACT STRENGTH BASF SE (DE) 2014-12-24 EP disclosed
WO-2014122075-A1 LUBRICANT COMPOSITIONS FOR THERMOPLASTIC POLYMERS BASF SE (DE) 2014-08-14 WO disclosed
WO-2013120792-A1 PVC COMPOSITIONS OF HIGH IMPACT STRENGTH BASF SE (DE) 2013-08-22 WO disclosed
US-6013703-A AN ORGANIC ZINC COMPOUND AND AN ORGANIC ALUMINIUM, SODIUM OR POTASSIUM COMPOUND IN COMBINATION WITH A STERICALLY HINDERED AMINES AS THE STABILIZER MIXTURE FOR POLYVINYL CHLORIDE; LEAD-FREE WITCO VINYL ADDITIVES GMBH (DE) 2000-01-11 US disclosed