SCHEMBL7210458

SCHEMBL7210458

O=C(C(=O)c1ccc(N2c3ccccc3Sc3ccccc32)cc1)c1ccc(N2c3ccccc3Sc3ccccc32)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.71
BCHE P06276 13/20 0.52
ACHE P22303 4/20 0.50
NOX1 Q9Y5S8 2/20 0.49
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43

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
SCHEMBL17851122 0.89 HDAC6 (0.71) HDAC6BCHEACHENOX1LMNA
SCHEMBL30874618 0.89 HDAC6 (0.71) HDAC6BCHEACHENOX1LMNA
SCHEMBL22146537 0.89 HDAC6 (0.71) HDAC6BCHEACHENOX1LMNA
SCHEMBL28545381 0.88 HDAC6 (0.69) HDAC6BCHEACHENOX1LMNA
SCHEMBL19268847 0.86 HDAC6 (0.68) HDAC6BCHEACHENOX1LMNA
SCHEMBL28077830 0.86 HDAC6 (0.68) HDAC6BCHEACHENOX1LMNA
SCHEMBL12190901 0.84 HDAC6 (0.62) HDAC6BCHEACHENOX1LMNA
SCHEMBL29851224 0.84 HDAC6 (0.62) HDAC6BCHEACHENOX1LMNA
SCHEMBL21419782 0.82 HDAC6 (0.62) HDAC6BCHEACHENOX1LMNA
SCHEMBL28555205 0.82 HDAC6 (0.67) HDAC6BCHEACHENOX1LMNA

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
US-6617053-B2 High luminous efficiency and a long life CHISSO CORPORATION (JP) 2003-09-09 US disclosed
US-20020027415-A1 Organic electroluminescent device containing dithiafulvene derivative CHISSO CORPORATION (JP) 2002-03-07 US disclosed