SCHEMBL1381865

SCHEMBL1381865

CCn1c2ccccc2c2cc(NC(=O)C3CN(CCCSC)CCN3S(=O)(=O)c3cccs3)ccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
NPY5R Q15761 5/20 0.44
REV1 Q9UBZ9 1/20 0.43
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
KDM4E B2RXH2 5/20 0.42
LMNA P02545 4/20 0.42
NPC1 O15118 2/20 0.42
ALDH1A1 P00352 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
USP2 O75604 2/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
HCRTR1 O43613 1/20 0.40
RORC P51449 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
SCHEMBL12995399 1.00 MAPT (0.61) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL12995366 0.91 MAPT (0.62) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL1378788 0.91 MAPT (0.62) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL14237565 0.89 MAPT (0.55) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL12995401 0.85 MAPT (0.61) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL6420401 0.84 MAPT (0.67) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL6420404 0.84 MAPT (0.67) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL12995395 0.84 MAPT (0.60) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL1382417 0.84 MAPT (0.60) MAPTL3MBTL1NPY5RREV1MEN1
SCHEMBL12995355 0.83 MAPT (0.63) MAPTL3MBTL1NPY5RREV1MEN1

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
JP-4713152-B2 2011-06-29 JP claimed