SCHEMBL367707

SCHEMBL367707

CS(=O)(=O)c1ccc2c(C(N)=O)c3ccccc3n2c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.44
SRC P12931 1/20 0.44
AGTR1 P30556 5/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
RORC P51449 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR6 P50406 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL367747 0.89 AGTR1 (0.48) EGFRAGTR1PTGDR2MEN1KMT2A
SCHEMBL365826 0.85 KMT2A (0.48) EGFRSRCMEN1KMT2ALMNA
SCHEMBL366999 0.85 EGFR (0.42) EGFRSRCMEN1KMT2ALMNA
SCHEMBL366741 0.81 EGFR (0.38) EGFRSRCAGTR1MEN1KMT2A
SCHEMBL367764 0.79 EGFR (0.45) EGFRSRCMEN1KMT2AHTR2A
SCHEMBL367201 0.79 EGFR (0.45) EGFRSRCAGTR1HTR2AHTR2C
SCHEMBL367330 0.78 EGFR (0.46) EGFRSRCKMT2AHTR2AHTR2C
SCHEMBL366109 0.78 EGFR (0.43) EGFRSRCAGTR1HTR2AHTR2C
SCHEMBL367706 0.78 BAZ2B (0.41) EGFRSRCMEN1KMT2APTGS2
SCHEMBL365722 0.77 PTGDR2 (0.35) AGTR1PTGDR2RORCMEN1KMT2A

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