SCHEMBL6276296

SCHEMBL6276296

COC(C)(OC)OC(=O)CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.37
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
DGAT1 O75907 1/20 0.32
GAA P10253 2/20 0.32
HSD17B10 Q99714 1/20 0.32
HMGCR P04035 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
ADRA1A P35348 1/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TET2 Q6N021 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 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
SCHEMBL6276294 0.88 TSHR (0.39) TSHRDGAT1GAAHSD17B10MGAM
SCHEMBL11720062 0.80 EGLN1 (0.43) TSHRHMGCRCHRM1TBXA2RADRA1A
SCHEMBL18735196 0.80 GAA (0.40) TSHRLDHASRRGAAHMGCR
SCHEMBL6276285 0.78 GAA (0.34) TSHRLDHASRRGAAHMGCR
SCHEMBL7588762 0.78 LDHA (0.40) TSHRLDHASRRDGAT1GAA
SCHEMBL52738 0.78 MEN1 (0.42) TSHRLDHASRRDGAT1GAA
SCHEMBL11720051 0.78 TSHR (0.46) TSHRDGAT1GAAHSD17B10ADRA1A
SCHEMBL20487213 0.77 TSHR (0.37) TSHRLDHASRRDGAT1GAA
SCHEMBL10918517 0.77 TSHR (0.57) TSHRHSD17B10MEN1KMT2A
Ammonia Solution, Strong SCHEMBL3971260 0.76 MEN1 (0.41) TSHRLDHASRRDGAT1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050123781-A1 One-component flexible etch resistant clearcoat NIPPON PAINT (USA), INC. 2005-06-09 US disclosed
EP-1538172-A1 One-component flexible etch resistant clearcoat ROHM AND HAAS COMPANY (US) 2005-06-08 EP disclosed