SCHEMBL17812749

SCHEMBL17812749

CCCCCCCCCCCCCCCOC(=O)C1(C(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.48
HCAR2 Q8TDS4 2/20 0.46
EPHX1 P07099 1/20 0.46
TSHR P16473 3/20 0.44
CES2 O00748 1/20 0.43
PSEN1 P49768 3/20 0.43
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
PRKCA P17252 2/20 0.41
ACHE P22303 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
SCHEMBL16086397 1.00 NAAA (0.48) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL17812789 1.00 NAAA (0.48) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL2854609 0.98 NAAA (0.46) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL16086400 0.93 NAAA (0.46) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL16086712 0.93 NAAA (0.46) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL17812502 0.93 NAAA (0.46) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL3104104 0.93 ALDH1A1 (0.47) NAAAHCAR2EPHX1TSHRPSEN1
SCHEMBL16599843 0.92 NAAA (0.44) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL16086415 0.92 NAAA (0.44) NAAAHCAR2EPHX1TSHRCES2
SCHEMBL2541015 0.92 NAAA (0.44) NAAAHCAR2EPHX1TSHRCES2

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