SCHEMBL19344499

SCHEMBL19344499

CC(C)(C)OC(=O)N1CCC2(CC1)CCN2CC1CC[C@H](c2ccc3c(N)ncnn23)O1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.37
▸ MAP4K4 O95819 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ NAMPT P43490 6/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ KDM1A O60341 1/20 0.34

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
SCHEMBL23584806 0.96 CNR2 (0.37) GPR119MAP4K4FAAHOPRD1OPRK1
SCHEMBL23584795 0.91 CNR2 (0.37) GPR119MAP4K4OPRD1OPRK1BACE1
SCHEMBL22434806 0.91 CNR2 (0.37) GPR119MAP4K4OPRD1OPRK1BACE1
SCHEMBL23584488 0.87 RIPK1 (0.34) GPR119MAP4K4OPRD1OPRK1NAMPT
SCHEMBL23584808 0.82 EIF2AK4 (0.35) MAP4K4NAMPTRIPK1
SCHEMBL19344509 0.82 CNR2 (0.40) MAP4K4BACE1NAMPTRIPK1
SCHEMBL23584768 0.82 CNR2 (0.40) MAP4K4BACE1NAMPTRIPK1
SCHEMBL22435090 0.81 OPRD1 (0.34) MAP4K4FAAHOPRD1OPRK1BACE1
SCHEMBL23584737 0.80 CNR2 (0.38) GPR119OPRD1OPRK1BACE1NAMPT
SCHEMBL23584495 0.79 PRMT5 (0.47) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3426664-B1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-06-30 — — EP disclosed
WO-2017153186-A1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-14 — — WO disclosed
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