SCHEMBL5399544

SCHEMBL5399544

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
USP2 O75604 1/20 0.39
TSHR P16473 3/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TET2 Q6N021 1/20 0.31
RECQL P46063 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL5384648 0.90 GAA (0.41) LMNAUSP2ALDH1A1MGAMGAA
SCHEMBL5399550 0.88 LMNA (0.37) LMNAUSP2TSHRALDH1A1HSD17B10
SCHEMBL168730 0.88 TSHR (0.43) LMNAUSP2TSHRALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL28166385 0.86 TSHR (0.42) LMNAUSP2TSHRALDH1A1HSD17B10
Methoxymethane SCHEMBL28184894 0.86 TSHR (0.42) LMNAUSP2TSHRALDH1A1HSD17B10
SCHEMBL5384696 0.84 LMNA (0.44) LMNAUSP2TSHRALDH1A1HSD17B10
SCHEMBL5380784 0.84 GAA (0.42) LMNAUSP2ALDH1A1MGAMGAA
SCHEMBL5380792 0.81 GAA (0.43) LMNAUSP2ALDH1A1MGAMGAA
Triethyl Citrate SCHEMBL21518137 0.81 GAA (0.43) LMNAUSP2TSHRALDH1A1MGAM
Ammonia Solution, Strong SCHEMBL10905903 0.80 USP2 (0.42) LMNAUSP2TSHRALDH1A1HSD17B10

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-7166654-B2 Ester compound, plasticizer for biodegradable aliphatic polyester resin, and biodegradable resin composition DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-01-23 US claimed