SCHEMBL13618546

SCHEMBL13618546

CO[C@H]1CC[C@H](C[SH](C)(=O)C(C)(C)C(=O)NN)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.31

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
SCHEMBL13618552 0.90 ALDH1A1 (0.31)
SCHEMBL13618715 0.80 CNR2 (0.30)
SCHEMBL10147807 0.71 MAPK8 (0.32) MAPK8
SCHEMBL10176671 0.70 CNR2 (0.38) MAPK8
SCHEMBL352503 0.70 CNR2 (0.38) MAPK8
SCHEMBL338018 0.62 TSHR (0.44)
SCHEMBL337044 0.61 GRM1 (0.38)
SCHEMBL337453 0.61 BRD4 (0.43)
SCHEMBL1966898 0.61 GRM1 (0.38)
SCHEMBL30622698 0.61 ADORA3 (0.40) MAPK8

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
WO-2009140089-A2 SULFONE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-19 WO disclosed