SCHEMBL10147583

SCHEMBL10147583

Cn1nc(C(C)(C)C)cc1-c1cnc(C(C)(C)Sc2ccc(Cl)cc2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.39
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
LMNA P02545 1/20 0.33
STIM1 Q13586 1/20 0.32
ORAI1 Q96D31 1/20 0.32
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
GFER P55789 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL10147796 0.81 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147538 0.81 MAPK14 (0.40) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL350333 0.79 CNR2 (0.47) SCN10AMAPTMAPK13MAPK12MAPK11
SCHEMBL18407334 0.79 KDM4E (0.38) SCN10AMAPTMAPK13MAPK12MAPK11
SCHEMBL10147508 0.76 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147542 0.72 MAPK13 (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147546 0.71 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL10147503 0.71 MAPT (0.37) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL1253145 0.70 SCN5A (0.41) SCN10AMAPTMAPK13MAPK12MAPK11
SCHEMBL18415303 0.68 KDM5B (0.36) MAPTLMNA

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