SCHEMBL17812808

SCHEMBL17812808

CCCCCCCCCCCCCOC(=O)C1(C(=O)OCCCCCCCCCCCCC)CCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
EPHX1 P07099 1/20 0.47
TSHR P16473 3/20 0.46
CES2 O00748 1/20 0.44
HCAR2 Q8TDS4 1/20 0.43
RAD52 P43351 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
FAAH O00519 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
ACHE P22303 6/20 0.42
DGKA P23743 1/20 0.41

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
SCHEMBL17812547 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812668 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812771 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL16086711 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812551 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812531 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812445 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812830 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL17812609 1.00 NAAA (0.50) NAAAEPHX1TSHRCES2HCAR2
SCHEMBL16086075 0.98 NAAA (0.47) NAAAEPHX1TSHRCES2HCAR2

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