SCHEMBL23584737

SCHEMBL23584737

CSc1ncnn2c([C@H]3CC[C@@H](CN4CC(F)(F)CC45CCN(C(=O)OC(C)(C)C)CC5)O3)ccc12

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.38
▸ CNR1 P21554 1/20 0.33
▸ GPR119 Q8TDV5 7/20 0.32
▸ NAMPT P43490 6/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ OPRK1 P41145 1/20 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
SCHEMBL22434806 0.90 CNR2 (0.37) CNR2CNR1GPR119NAMPTBACE1
SCHEMBL23584795 0.90 CNR2 (0.37) CNR2CNR1GPR119NAMPTBACE1
SCHEMBL19344522 0.86 CNR2 (0.35) CNR2CNR1GPR119NAMPT
SCHEMBL23584685 0.85 PRMT5 (0.31) —
SCHEMBL19344525 0.84 CNR2 (0.34) CNR2
SCHEMBL23584605 0.84 PRMT5 (0.30) —
SCHEMBL23584604 0.83 — —
SCHEMBL23584733 0.80 EIF2AK4 (0.34) GPR119NAMPT
SCHEMBL19344499 0.80 GPR119 (0.37) GPR119NAMPTBACE1OPRD1OPRK1
SCHEMBL23584683 0.79 KCNH2 (0.33) —

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-3426664-B1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-06-30 — — EP disclosed
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