SCHEMBL367245

SCHEMBL367245

NC(=O)c1c2ccccc2n2cc(OS(=O)(=O)C3CC3)cc(O)c12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.33
SRC P12931 1/20 0.33
HTR3A P46098 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL367390 0.90 AGTR1 (0.34) EGFRHTR3AMEN1KMT2A
SCHEMBL366075 0.87 MAPT (0.35) EGFRSRCMEN1KMT2A
SCHEMBL366116 0.78 CA1 (0.41) EGFR
SCHEMBL365226 0.77 ATM (0.37) HTR2AHTR2CMEN1KMT2A
SCHEMBL365264 0.75 EPHX1 (0.45) MEN1KMT2ANPC1
SCHEMBL365256 0.75 EGFR (0.40) EGFRSRCMEN1KMT2ANPC1
SCHEMBL367244 0.74 KDM4E (0.33) MEN1KMT2A
SCHEMBL367222 0.74 EGFR (0.41) EGFRSRCHTR2AHTR2CNPC1
SCHEMBL366567 0.74 PSEN1 (0.38) EGFRSRCMEN1KMT2A
SCHEMBL365771 0.72 EGFR (0.43) EGFRSRCHTR2AHTR2CMEN1

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