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) —
SCHEMBL1966898 0.61 GRM1 (0.38) —
SCHEMBL10086748 0.61 BRD4 (0.43) —
SCHEMBL337453 0.61 BRD4 (0.43) —
SCHEMBL337044 0.61 GRM1 (0.38) —

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
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