SCHEMBL9543814

SCHEMBL9543814

COC(=O)COc1ccc([Te]c2ccc(O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.54
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL11151346 0.93 PTGS2 (0.59) PTGS2MAPTGAAALDH1A1CYP2C9
Hydrochloric Acid SCHEMBL11148582 0.92 PTGS2 (0.58) PTGS2MAPTGAAALDH1A1CYP2C9
Hydrochloric Acid SCHEMBL11148593 0.92 PTGS2 (0.58) PTGS2MAPTGAAALDH1A1CYP2C9
SCHEMBL197602 0.90 PTGS2 (0.58) PTGS2MAPTTP53GAAALDH1A1
SCHEMBL11148532 0.83 PTGS2 (0.55) PTGS2MAPTGAAALDH1A1CYP2C9
SCHEMBL2116437 0.82 PTGS2 (0.66) PTGS2MAPTGAAALDH1A1CYP2C9
SCHEMBL10421964 0.82 PTGS2 (0.51) PTGS2MAPTTP53GAAALDH1A1
SCHEMBL9544330 0.81 ALOX15 (0.55) MAPTALDH1A1MEN1KMT2APPARG
SCHEMBL5908176 0.79 GAA (0.63) PTGS2GAAALDH1A1CYP2C9CYP2C19
SCHEMBL1507822 0.79 PTGS2 (0.49) PTGS2MAPTTP53GAAALDH1A1

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-1993016993-A1 ANTIOXIDANT DIARYL TELLURIDES AKTIEBOLAGET ASTRA (SE) 1993-09-02 WO disclosed