SCHEMBL6826489

SCHEMBL6826489

Cc1ccc(C)c(SC(=O)c2cccc(C=O)n2)c1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TERT O14746 15/20 0.68
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL6828872 0.85 TERT (0.71) TERTMEN1ALDH1A1KMT2A
SCHEMBL6828762 0.81 TERT (1.00) TERTMEN1ALDH1A1KMT2A
SCHEMBL6828814 0.74 TERT (1.00) TERTMEN1ALDH1A1KMT2A
SCHEMBL6831139 0.74 TERT (0.51) TERTALDH1A1KMT2A
SCHEMBL6831025 0.74 RAB9A (0.60) TERTMEN1ALDH1A1KMT2A
SCHEMBL6829046 0.74 TERT (1.00) TERT
SCHEMBL6826433 0.73 TERT (1.00) TERT
SCHEMBL6828867 0.71 ALDH1A1 (0.38) TERTL3MBTL1MEN1ALDH1A1KMT2A
SCHEMBL6829564 0.71 TERT (1.00) TERT
SCHEMBL6831258 0.71 TERT (1.00) TERTMEN1ALDH1A1KMT2A

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