SCHEMBL6329652

SCHEMBL6329652

CCOC(=O)CCC(CCC(=O)OCC)(CCC(=O)OCC)CCC(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
MGAM O43451 1/20 0.52
SI P14410 1/20 0.52
MGAM2 Q2M2H8 1/20 0.52
CYP1A2 P05177 1/20 0.52
ALDH1A1 P00352 5/20 0.48
TRPA1 O75762 1/20 0.48
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
LMNA P02545 2/20 0.42
HSD17B10 Q99714 2/20 0.42
NR1I2 O75469 1/20 0.41
PGR P06401 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
PTGS2 P35354 1/20 0.41
PDE4D Q08499 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALOX15 P16050 2/20 0.40
POLB P06746 2/20 0.40
TSHR P16473 2/20 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
SCHEMBL27581370 0.89 CYP1A2 (0.48) GAAMGAMSIMGAM2CYP1A2
Ammonia Solution, Strong SCHEMBL3920821 0.89 CYP1A2 (0.47) GAAMGAMSIMGAM2CYP1A2
SCHEMBL1717311 0.87 CYP1A2 (0.55) GAAMGAMSIMGAM2CYP1A2
SCHEMBL3368077 0.83 ALDH1A1 (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL28378490 0.83 GAA (0.50) GAAMGAMSIMGAM2CYP1A2
SCHEMBL1406291 0.81 CYP1A2 (0.48) GAAMGAMSIMGAM2CYP1A2
SCHEMBL1700886 0.81 CYP1A2 (0.48) GAAMGAMSIMGAM2CYP1A2
SCHEMBL2001288 0.81 CYP1A2 (0.54) GAAMGAMSIMGAM2CYP1A2
SCHEMBL196812 0.81 CYP1A2 (0.48) GAAMGAMSIMGAM2CYP1A2
SCHEMBL9157515 0.81 CYP1A2 (0.48) GAAMGAMSIMGAM2CYP1A2

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
US-6889735-B2 Pneumatic tire having a rubber component containing a dendrimer THE GOODYEAR TIRE & RUBBER COMPANY (US) 2005-05-10 US disclosed
US-20040020576-A1 Pneumatic tire having a rubber component containing a dendrimer THE GOODYEAR TIRE & RUBBER COMPANY 2004-02-05 US disclosed
US-20020068796-A1 Pneumatic tire having a rubber component containing a dendrimer FRANK UWE ERNST (DE) 2002-06-06 US disclosed
EP-1177919-A2 A pneumatic tire having a rubber component containing a dendrimer THE GOODYEAR TIRE & RUBBER COMPANY (US) 2002-02-06 EP disclosed