SCHEMBL28616219

SCHEMBL28616219

CN(C)C1CCN(c2cnc(C(N)C(=O)OC(C)(C)C)nc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.36
L3MBTL3 Q96JM7 1/20 0.34
HCK P08631 2/20 0.34
SRC P12931 2/20 0.34
FRK P42685 2/20 0.34
BLK P51451 2/20 0.34
PTK6 Q13882 2/20 0.34
ABL1 P00519 1/20 0.34
PDE10A Q9Y233 1/20 0.33
TIPARP Q7Z3E1 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
LYN P07948 1/20 0.33

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
SCHEMBL28664515 0.77 FYN (0.41) GPR119HCKSRCFRKBLK
SCHEMBL21267364 0.73 CDK4 (0.40) L3MBTL3
SCHEMBL28611481 0.72 L3MBTL3 (0.42) L3MBTL3
SCHEMBL16892009 0.70 PTPN11 (0.42) L3MBTL3LCK
SCHEMBL19066144 0.70 L3MBTL3 (0.35) L3MBTL3
SCHEMBL20311336 0.68 ACVR1 (0.42) L3MBTL3
SCHEMBL28484682 0.68 KMT2A (0.37) GPR119
SCHEMBL30700827 0.68 AAK1 (0.43) GPR119PDE10A
SCHEMBL20037702 0.68 AAK1 (0.43) GPR119PDE10A
SCHEMBL10118830 0.67 MCHR1 (0.49) GPR119HCKSRCFRKBLK

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
CN-113549069-A Kinase inhibitor 重庆复创医药研究有限公司 2021-10-26 CN disclosed
CN-108779117-B Kinase inhibitor 重庆复创医药研究有限公司 2021-08-31 CN disclosed