SCHEMBL6829097

SCHEMBL6829097

O=Cc1cccc(C(=O)Oc2ccc(F)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TERT O14746 12/20 0.58
ALDH1A1 P00352 2/20 0.53
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
MAPT P10636 4/20 0.44
MPI P34949 1/20 0.41
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40

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 0.85 ALDH1A1 (0.74) TERTALDH1A1KMT2AMAPTMPI
SCHEMBL6831133 0.85 TERT (0.58) TERTALDH1A1KMT2AMAPTMPI
SCHEMBL6826477 0.85 TERT (0.65) TERTALDH1A1KMT2AMAPTMPI
SCHEMBL6831103 0.85 TERT (0.57) TERTALDH1A1KMT2AMAPTMPI
SCHEMBL6828768 0.82 ALDH1A1 (0.52) TERTALDH1A1KMT2AMAPTMPI
SCHEMBL6828668 0.79 TERT (0.57) TERTALDH1A1KMT2AMAPTCYP1A2
SCHEMBL6830993 0.79 TERT (0.48) TERTALDH1A1MAPTCYP1A2
SCHEMBL6829662 0.78 TERT (0.50) TERTALDH1A1MAPTCYP1A2
SCHEMBL2348998 0.74 TERT (0.55) TERTMAPTCYP1A2GAARECQL
SCHEMBL6831125 0.73 TERT (1.00) TERTALDH1A1KMT2AMAPT

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