SCHEMBL17812804

SCHEMBL17812804

CCCCCCCCCCCOC(=O)C1(C(=O)OCCCCCCCCCCC)CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.48
EPHX1 P07099 1/20 0.46
TSHR P16473 3/20 0.44
CES2 O00748 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
HCAR2 Q8TDS4 1/20 0.42
RAD52 P43351 1/20 0.42
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
ACHE P22303 6/20 0.41
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL17812541 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL588990 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL17812470 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL17812682 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL22361226 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL16949814 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL2059887 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL16949823 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL17812758 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1
SCHEMBL17812721 1.00 NAAA (0.48) NAAAEPHX1TSHRCES2NPSR1

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-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed