SCHEMBL8569867

SCHEMBL8569867

CCC(C)CC(=O)OCCO

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
MGLL Q99685 1/20 0.37
ACHE P22303 1/20 0.36
TSHR P16473 1/20 0.34
ALDH1A1 P00352 3/20 0.34
PRKCA P17252 1/20 0.33
MAPT P10636 2/20 0.33
NAAA Q02083 1/20 0.32
DGKA P23743 1/20 0.32
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL18730849 0.89 TSHR (0.38) MGLLACHETSHRALDH1A1PRKCA
SCHEMBL17350548 0.89 ELANE (0.41) ELANETSHRALDH1A1PRKCAMAPT
SCHEMBL2356624 0.85 ELANE (0.39) ELANETSHRALDH1A1MAPTNAAA
SCHEMBL1031054 0.83 ALDH1A1 (0.39) ELANETSHRALDH1A1MAPTNAAA
Ether SCHEMBL2247324 0.82 ALDH1A1 (0.33) ELANETSHRALDH1A1MAPTNAAA
SCHEMBL23646835 0.82 NAAA (0.48) ELANETSHRALDH1A1MAPTNAAA
SCHEMBL22115798 0.82 ALDH1A1 (0.38) ELANETSHRALDH1A1MAPTNAAA
SCHEMBL2656304 0.82 ALDH1A1 (0.33) MGLLACHETSHRALDH1A1PRKCA
SCHEMBL11022032 0.82 ELANE (0.37) ELANEMAPTNAAADGKAMAPK1
SCHEMBL1456349 0.80 MGAM (0.50) ELANETSHRALDH1A1L3MBTL1

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-5830936-A THERMAL STABILIZERS FOR POLYOLEFINS AND ENGINEERING PLASTICS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-11-03 US disclosed