SCHEMBL6604906

SCHEMBL6604906

COc1cccc(CNC(=O)Oc2ccc3c(c2)S(=O)(=O)N(Cc2ccccc2)C(=O)N3C)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
FBP1 P09467 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.46
TP53 P04637 2/20 0.45
NR3C2 P08235 1/20 0.45
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
THRB P10828 1/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MMP13 P45452 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL6607141 0.87 MMP13 (0.53) L3MBTL1FBP1TDP1GAATHRB
SCHEMBL6608012 0.85 LMNA (0.41) L3MBTL1TP53ALDH1A1THRBLMNA
SCHEMBL6605189 0.83 MMP13 (0.60) L3MBTL1TDP1THRBLMNAMMP13
SCHEMBL6517676 0.76 MAPT (0.44) ALDH1A1LMNAPOLB
SCHEMBL6512902 0.75 ALDH1A1 (0.53) GAATP53ALDH1A1SMN1; SMN2POLB
SCHEMBL6606492 0.75 LMNA (0.52) THRBLMNAMMP13
SCHEMBL6609494 0.74 LMNA (0.51) SMN1; SMN2THRBNPC1LMNAPOLB
SCHEMBL16494249 0.73 ACHE (0.55) TP53ALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL6605355 0.73 LMNA (0.51) ALDH1A1SMN1; SMN2THRBNPC1LMNA
SCHEMBL6517128 0.72 MEN1 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368327-B1 BENZO THIADIAZINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-10-20 EP claimed