SCHEMBL7203544

SCHEMBL7203544

COC(=O)C(C(=O)OC)(C(=O)OC)C(=O)OCC(COC(=O)C(C(=O)OC)(C(=O)OC)C(=O)OC)(COC(=O)C(C(=O)OC)(C(=O)OC)C(=O)OC)COC(=O)C(C(=O)OC)(C(=O)OC)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
MAPK1 P28482 2/20 0.33
HIF1A Q16665 2/20 0.33
DGAT1 O75907 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
KCNN4 O15554 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7199784 0.81 MGAM (0.44) TSHRMGAMGAASIMGAM2
SCHEMBL8096308 0.79 DGAT1 (0.46) TSHRDGAT1MGAMGAASI
SCHEMBL12670586 0.78 GAA (0.52) TSHRMGAMGAASIMGAM2
SCHEMBL12561094 0.72 PRKCA (0.43) MAPK1HIF1AGAAALDH1A1TP53
SCHEMBL9443410 0.72 MAPK1 (0.37) TSHRMAPK1HIF1AMGAMGAA
SCHEMBL12938589 0.70 MAPK1 (0.32) MAPK1HIF1A
SCHEMBL1597489 0.68 MAPK1 (0.39) MAPK1HIF1AGAAALDH1A1TP53
SCHEMBL14075105 0.68 MAPK1 (0.34) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL14075104 0.68 MAPK1 (0.34) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL1171107 0.68 MAPK1 (0.34) MAPK1HIF1AALDH1A1TP53CYP3A4

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
WO-2003064502-A1 POLYESTER DENDRIMERS, METHOD FOR THE MANUFACTURE THEREOF, AND THEIR USE UNIVERSITY OF JYVÄSKYLÄ (FI) 2003-08-07 WO disclosed