SCHEMBL20147043

SCHEMBL20147043

COc1ccc(OS(=O)(=O)C(F)(F)F)c(S(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
TP53 P04637 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
SCHEMBL6938157 0.86 CA12 (0.55) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL6935409 0.83 CA12 (0.55) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL29134970 0.81 EPAS1 (0.43) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL5980992 0.81 GAA (0.43) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL15417657 0.81 L3MBTL1 (0.41) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL23571966 0.80 DRD2 (0.37) KMT2ASMN1; SMN2LMNATP53
SCHEMBL1411326 0.80 ALDH1A1 (0.44) L3MBTL1GAAALDH1A1TP53
SCHEMBL1304599 0.78 MTNR1A (0.41) L3MBTL1KMT2AMAPTALDH1A1MEN1
SCHEMBL2296015 0.78 L3MBTL1 (0.38) L3MBTL1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL10020233 0.78 ALDH1A1 (0.49) MAPTALDH1A1LMNA

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-2213641-B1 FUSED AROMATIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO (JP) 2018-05-16 EP disclosed