SCHEMBL7735908

SCHEMBL7735908

CCOC(=O)c1ccccc1OC(=O)OC(=O)Oc1ccccc1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
SLC6A3 Q01959 1/20 0.55
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 3/20 0.49
HTT P42858 1/20 0.49
MAPT P10636 4/20 0.48
CDC25B P30305 1/20 0.47
LMNA P02545 2/20 0.45
GAA P10253 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45

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
SCHEMBL2842657 0.94 TSHR (0.61) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL5705966 0.91 SLC6A3 (0.59) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL5706247 0.91 SLC6A3 (0.59) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL4391331 0.89 SLC6A3 (0.59) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL2910803 0.89 KDM4E (0.63) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL5706110 0.88 TSHR (0.66) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL1283310 0.88 TSHR (0.69) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL8499927 0.86 TSHR (0.51) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL4391361 0.86 TSHR (0.67) TSHRSLC6A3KDM4EHSD17B10ALDH1A1
SCHEMBL6439342 0.85 SLC6A3 (0.72) TSHRSLC6A3KDM4EHSD17B10ALDH1A1

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-6417291-B1 CONDENSATION POLYMERIZATION AND ESTERIFICATION OF AROMATIC DIOL AND ESTER-FORMING MONOMER; ENDCAPPING WITH SALICYLIC ACID ESTER DERIVATIVE TEIJIN LIMITED (JP) 2002-07-09 US disclosed