SCHEMBL367750

SCHEMBL367750

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
PLA2G4A P47712 1/20 0.40
EGFR P00533 1/20 0.40
MAPK1 P28482 1/20 0.39
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
TPMT P51580 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 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
SCHEMBL367766 0.93 L3MBTL1 (0.43) L3MBTL1MAPTKMT2APLA2G4AEGFR
SCHEMBL365176 0.91 ATM (0.45) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL365273 0.90 PLA2G4A (0.45) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL366559 0.90 ATM (0.47) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL365021 0.86 SMN1; SMN2 (0.42) ATML3MBTL1MAPTKMT2APLA2G4A
SCHEMBL366034 0.86 ATM (0.41) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL366077 0.84 ATM (0.45) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL367256 0.82 EGFR (0.40) L3MBTL1KDM4EMAPTKMT2AMEN1
SCHEMBL366020 0.80 STS (0.41) ATML3MBTL1KDM4EMAPTKMT2A
SCHEMBL365192 0.80 EGFR (0.41) ATML3MBTL1MAPTKMT2AMEN1

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