SCHEMBL9959934

SCHEMBL9959934

CCCCCCCCCCCCCCCCOC(=O)CC(O)(CC(=O)OCCCCCCCCCC)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.58
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FAAH O00519 2/20 0.49
DGKA P23743 1/20 0.48
HTR2C P28335 1/20 0.47
HCAR2 Q8TDS4 2/20 0.46
EPHX1 P07099 1/20 0.46
TSHR P16473 2/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43

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
SCHEMBL11024868 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL27577991 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL27712702 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL1958039 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL1278242 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL5961664 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL6288813 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL417322 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL513363 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL10795018 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA

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
EP-2655511-A1 THERMOPLASTIC ELASTOMER COMPOSITION AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2013-10-30 EP disclosed
WO-2012084914-A1 THERMOPLASTIC ELASTOMER COMPOSITION AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2012-06-28 WO disclosed