SCHEMBL19344522

SCHEMBL19344522

CC(C)C(=O)Nc1ncnn2c([C@H]3CC[C@@H](CN4CC(F)(F)CC45CCN(C(=O)OC(C)(C)C)CC5)O3)ccc12

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.35
▸ JAK1 P23458 5/20 0.32
▸ JAK2 O60674 4/20 0.32
▸ TRPV3 Q8NET8 1/20 0.32
▸ NAMPT P43490 6/20 0.32
▸ CNR1 P21554 1/20 0.31
▸ GPR119 Q8TDV5 3/20 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
SCHEMBL23584611 0.89 PRMT5 (0.30) —
SCHEMBL22434806 0.87 CNR2 (0.37) CNR2JAK1JAK2NAMPTCNR1
SCHEMBL23584795 0.87 CNR2 (0.37) CNR2JAK1JAK2NAMPTCNR1
SCHEMBL23584737 0.86 CNR2 (0.38) CNR2NAMPTCNR1GPR119
SCHEMBL19344515 0.86 CNR2 (0.32) CNR2JAK1JAK2
SCHEMBL23584687 0.78 PRMT5 (0.36) —
SCHEMBL23584806 0.76 CNR2 (0.37) CNR2NAMPTCNR1GPR119
SCHEMBL24606323 0.75 TSHR (0.32) —
SCHEMBL19344517 0.74 PRMT5 (0.31) —
SCHEMBL23584658 0.74 CNR2 (0.37) CNR2CNR1GPR119

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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