SCHEMBL6828762

SCHEMBL6828762

Cc1cccc(SC(=O)c2cccc(C=O)n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TERT O14746 15/20 1.00
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 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
SCHEMBL6826178 0.83 TERT (1.00) TERTMAPTMEN1KMT2AHPGD
SCHEMBL6829714 0.83 TERT (1.00) TERTALDH1A1
SCHEMBL6826489 0.81 TERT (0.68) TERTMEN1KMT2AALDH1A1
SCHEMBL6830042 0.80 TERT (1.00) TERTALDH1A1
SCHEMBL6829640 0.80 TERT (1.00) TERT
SCHEMBL6829564 0.79 TERT (1.00) TERT
SCHEMBL6922934 0.77 TERT (1.00) TERTMAPTALDH1A1
SCHEMBL6831125 0.77 TERT (1.00) TERTMAPTMEN1KMT2ANPSR1
SCHEMBL6826112 0.77 TERT (1.00) TERTKMT2A
SCHEMBL6829690 0.77 TERT (1.00) TERTMAPTMEN1KMT2AHPGD

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