SCHEMBL10147508

SCHEMBL10147508

Cn1nc(C(C)(C)C)cc1-c1cnc(C(C)(C)Sc2ccc(Cl)cc2)o1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
CNR2 P34972 1/20 0.34
PRKCZ Q05513 1/20 0.33
STIM1 Q13586 1/20 0.32
ORAI1 Q96D31 1/20 0.32
LMNA P02545 1/20 0.31
NOTUM Q6P988 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
SCHEMBL10147542 0.81 MAPK13 (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL351741 0.79 CNR2 (0.47) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10146112 0.79 PIK3CG (0.38) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147503 0.78 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147796 0.76 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL13618555 0.76 KDM4E (0.36)
SCHEMBL10147583 0.76 SCN10A (0.39) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147546 0.73 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147538 0.72 MAPK14 (0.40) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147586 0.70 CNR2 (0.35) 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