SCHEMBL9682984

SCHEMBL9682984

Cc1ccc(S(=O)(=O)c2nc(-c3ccccc3Nc3c(Cl)ccc(C)c3Cl)ns2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 4/20 0.49
PTGS2 P35354 6/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPT P10636 3/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 2/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42
METTL3 Q86U44 2/20 0.42

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
SCHEMBL9682970 0.83 KMT2A (0.41) MEN1KMT2AMAPTLMNACYP1A2
SCHEMBL9027930 0.80 L3MBTL1 (0.43) MEN1KMT2AMAPTLMNAGAA
SCHEMBL9684818 0.74 CLCN2 (0.54) CLCN2PTGS2MEN1KMT2AMAPT
SCHEMBL9683792 0.73 CLCN2 (0.52) CLCN2PTGS2MEN1KMT2AMAPT
SCHEMBL9683784 0.72 CLCN2 (0.53) CLCN2PTGS2MEN1KMT2AMAPT
SCHEMBL14755496 0.72 TASP1 (0.44) PTGS2GAATHRBTSHRPTGS1
SCHEMBL8075141 0.71 ADORA3 (0.50) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL7911040 0.70 CLCN2 (0.59) CLCN2PTGS2MEN1KMT2AMAPT
SCHEMBL14755599 0.69 GAA (0.48) PTGS2MEN1KMT2AMAPTGAA
SCHEMBL14755635 0.69 ADORA3 (0.48) MEN1KMT2AMAPTMAPK1LMNA

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
US-5114958-A Lipoxygenase or cyclooxygenase inhibitors WARNER-LAMBERT COMPANY (US) 1992-05-19 US disclosed