SCHEMBL7032174

SCHEMBL7032174

Cc1ccccc1C(=O)c1ccc(SNc2ccccn2)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 10/20 0.49
MAPK12 P53778 10/20 0.49
MAPK11 Q15759 10/20 0.49
MAPK14 Q16539 10/20 0.49
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GRM4 Q14833 1/20 0.41
RAB9A P51151 3/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
NPC1 O15118 2/20 0.39
CTNNB1 P35222 1/20 0.39
WNT3A P56704 1/20 0.39
NTRK1 P04629 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
SCHEMBL7036689 0.93 MAPK13 (0.46) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7033522 0.88 MAPK13 (0.51) MAPK13MAPK12MAPK11MAPK14TDP1
SCHEMBL7036626 0.88 MAPK13 (0.46) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7033586 0.83 MAPK13 (0.53) MAPK13MAPK12MAPK11MAPK14
SCHEMBL7030728 0.81 MAPK13 (0.48) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7037902 0.81 MAPK13 (0.46) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7033611 0.81 MAPK13 (0.48) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7030739 0.81 MAPK13 (0.53) MAPK13MAPK12MAPK11MAPK14GRM4
SCHEMBL7039968 0.80 MAPK14 (0.69) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL7037776 0.80 MAPK13 (0.53) MAPK13MAPK12MAPK11MAPK14GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US claimed
EP-1289958-A2 BENZOPHENONES AS INHIBITORS OF IL-1$g(b) AND TNF-$g(a) Leo Pharma A/S (DK) 2003-03-12 EP disclosed
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US disclosed
WO-2001090074-A2 BENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) LEO PHARMA A/S (DK) 2001-11-29 WO disclosed