SCHEMBL366980

SCHEMBL366980

Cc1cccc(S(=O)(=O)NC(=O)c2c3ccccc3n3cc(OCC#N)ccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
FBP1 P09467 15/20 0.40
ALKBH2 Q6NS38 1/20 0.39
ALKBH3 Q96Q83 1/20 0.39
FTO Q9C0B1 1/20 0.39
MCL1 Q07820 1/20 0.36
HRH2 P25021 1/20 0.36
HRH1 P35367 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
SCHEMBL364821 0.90 ADAM17 (0.41) PTGER4
SCHEMBL366979 0.88 KMT2A (0.45) FLT1FLT4KDRFBP1ALKBH2
SCHEMBL364828 0.84 MCL1 (0.37) MCL1
SCHEMBL366344 0.83 PSEN1 (0.39) MCL1
SCHEMBL367074 0.81 LMNA (0.39) PTGER4MCL1
SCHEMBL364894 0.81 PSEN1 (0.39) PTGER4
SCHEMBL365932 0.80 ALDH1A1 (0.48) PTGER4FLT1FLT4KDRFBP1
SCHEMBL367542 0.79 PSEN1 (0.42) MCL1
SCHEMBL365499 0.79 P4HTM (0.38) PTGER4MCL1
SCHEMBL364820 0.79 KMT2A (0.46)

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-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed