SCHEMBL30728148

SCHEMBL30728148

CN(C)C(=O)c1cccc(CN(C)C2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.56
JAK1 P23458 1/20 0.56
GPR119 Q8TDV5 12/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
USP30 Q70CQ3 1/20 0.48
SLC2A1 P11166 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL29913505 1.00 JAK2 (0.56) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL803527 0.84 JAK2 (0.74) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL12736035 0.84 GPR119 (0.58) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL29913629 0.82 GPR119 (0.59) JAK2JAK1GPR119
SCHEMBL5571027 0.81 FAAH (0.56) GPR119MEN1KMT2AKDM4E
SCHEMBL25389253 0.78 GPR119 (0.59) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL8111282 0.78 JAK2 (0.78) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL8111279 0.78 JAK2 (0.78) JAK2JAK1GPR119MEN1KMT2A
SCHEMBL14285890 0.78 GPR119 (0.63) GPR119
SCHEMBL621706 0.77 GPR119 (0.51) JAK2JAK1GPR119

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
CN-117480161-A Novel 2, 3-dihydro-1H-pyrrolo [3,2-b ] pyridine derivatives as sigma ligands 塔拉森调理公司 2024-01-30 CN disclosed