SCHEMBL104652

SCHEMBL104652

CC(C)O[Al]OC(C)C.CCOC(=O)CC(C)=O.CCOC(=O)CC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.52
MGAM O43451 2/20 0.52
SI P14410 2/20 0.52
MGAM2 Q2M2H8 2/20 0.52
ALDH1A1 P00352 3/20 0.39
TRPA1 O75762 1/20 0.39
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX15 P16050 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
NLRP3 Q96P20 1/20 0.33

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
SCHEMBL49172 1.00 GAA (0.52) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL9507018 0.85 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28111990 0.84 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
Isopropyl Alcohol SCHEMBL4264567 0.84 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
Isopropyl Alcohol SCHEMBL4612528 0.84 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1330478 0.83
SCHEMBL15500 0.83
SCHEMBL1330988 0.83
SCHEMBL1332259 0.83
SCHEMBL1331762 0.83

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2426168-A2 Imitation metal engineering plastic composite material and preparation method of the same Xiamen runner industrial corporation (CN) 2012-03-07 EP claimed
EP-2426168-B1 Imitation metal engineering plastic composite material and preparation method of the same XIAMEN RUNNER IND CORP (CN) 2017-06-14 EP disclosed
US-20130062805-A1 METHOD FOR PREPARATION OF IMITATION METAL ENGINEERING PLASTIC COMPOSITE MATERIAL XIAMEN RUNNER INDUSTRIAL CORPORATION (CN) 2013-03-14 US disclosed
EP-2426168-A2 Imitation metal engineering plastic composite material and preparation method of the same Xiamen runner industrial corporation (CN) 2012-03-07 EP disclosed