SCHEMBL366077

SCHEMBL366077

COc1cc(O)cn2c1c(C(=O)O)c1ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 5/20 0.45
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
EGFR P00533 1/20 0.40
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL365192 0.88 EGFR (0.41) ATMMAPTL3MBTL1KMT2AMEN1
SCHEMBL365176 0.87 ATM (0.45) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL366559 0.86 ATM (0.47) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL367750 0.84 ATM (0.43) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL366034 0.82 ATM (0.41) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL366020 0.81 STS (0.41) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL367734 0.80 ATM (0.40) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL365106 0.79 KMT2A (0.39) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL365273 0.79 PLA2G4A (0.45) ATMKDM4EMAPTL3MBTL1KMT2A
SCHEMBL365226 0.77 ATM (0.37) ATMKDM4EMAPTL3MBTL1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed