SCHEMBL10147546

SCHEMBL10147546

Cn1nc(C(C)(C)C)cc1-c1nc(C(C)(C)Sc2ccc(Cl)cc2)no1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
MAPK14 Q16539 2/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
CNR2 P34972 1/20 0.36
PRKCZ Q05513 1/20 0.33
LMNA P02545 1/20 0.31
NR1H4 Q96RI1 1/20 0.30

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
SCHEMBL351030 0.79 CNR2 (0.50) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10146088 0.79 KDM4E (0.38) MAPTMAPK14CNR2LMNA
SCHEMBL10147542 0.79 MAPK13 (0.37) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL13618717 0.76 KDM4E (0.36)
SCHEMBL10147503 0.76 MAPT (0.37) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10147508 0.73 MAPT (0.37) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10147538 0.72 MAPK14 (0.40) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10147796 0.72 MAPT (0.37) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10147583 0.71 SCN10A (0.39) MAPTMAPK14MAPK13MAPK12MAPK11
SCHEMBL10147585 0.70 CNR2 (0.33) CNR2

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-2418207-A1 Sulfone compounds which modulate the CB2 receptor Boehringer Ingelheim International GmbH (DE) 2012-02-15 EP disclosed