SCHEMBL6826477

SCHEMBL6826477

COc1ccc(OC(=O)c2cccc(C=O)n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TERT O14746 8/20 0.65
ALDH1A1 P00352 2/20 0.56
MAPT P10636 6/20 0.47
GAA P10253 2/20 0.46
CYP1A2 P05177 2/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
MPI P34949 1/20 0.41

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
SCHEMBL6829502 0.88 ALDH1A1 (0.74) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL6829097 0.85 TERT (0.58) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL6831133 0.85 TERT (0.58) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL6828768 0.85 ALDH1A1 (0.52) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL2348998 0.81 TERT (0.55) TERTMAPTGAACYP1A2RECQL
SCHEMBL6829690 0.79 TERT (1.00) TERTALDH1A1MAPTGAAKMT2A
SCHEMBL6828668 0.79 TERT (0.57) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL6831103 0.79 TERT (0.57) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL3698207 0.74 CYP1A2 (0.72) TERTALDH1A1MAPTGAACYP1A2
SCHEMBL1185561 0.74 TERT (0.48) TERTALDH1A1CYP1A2

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-2004037808-A1 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2004-05-06 WO disclosed