SCHEMBL17090221

SCHEMBL17090221

CC(C)(C)S(=O)(=O)N[C@H]1CC[C@H](CNc2ccc(F)c(C(F)(F)F)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.51
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
CNR1 P21554 7/20 0.44
SLC22A12 Q96S37 1/20 0.41

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
SCHEMBL11935321 1.00 CNR2 (0.51) CNR2JAK2JAK1CNR1SLC22A12
SCHEMBL17090216 0.89 KMT2A (0.44) CNR2JAK2JAK1CNR1
SCHEMBL11935303 0.89 KMT2A (0.44) CNR2JAK2JAK1CNR1
SCHEMBL13564895 0.86 CNR2 (0.47) CNR2JAK2JAK1CNR1
SCHEMBL17090538 0.86 CNR2 (0.47) CNR2JAK2JAK1CNR1
SCHEMBL17090224 0.84 CNR2 (0.40) CNR2
SCHEMBL11935322 0.84 CNR2 (0.40) CNR2
SCHEMBL11936372 0.83 CNR2 (0.46) CNR2CNR1
SCHEMBL11936189 0.82 NPY5R (0.49) CNR2JAK2JAK1
SCHEMBL13105815 0.82 CNR2 (0.43) CNR2CNR1

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
US-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed