SCHEMBL28696384

SCHEMBL28696384

CC(C)(C)OC(=O)N(Cc1ccccc1N)C1CCN(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.50
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
CCR5 P51681 1/20 0.41
USP30 Q70CQ3 2/20 0.41
GPR119 Q8TDV5 5/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
OPRM1 P35372 1/20 0.37
STS P08842 1/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL22391801 0.87 HSD11B1 (0.51) HSD11B1MEN1KMT2AJAK2JAK1
SCHEMBL5367694 0.86 OPRM1 (0.54) HSD11B1OPRM1
SCHEMBL14410252 0.86 HSD11B1 (0.43) HSD11B1CCR5NR1H4SLC6A2SLC6A4
SCHEMBL28691449 0.83 HSD11B1 (0.47) HSD11B1MEN1KMT2A
SCHEMBL14417237 0.83 SLC6A4 (0.50) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL17560075 0.78 LIPE (0.41) MEN1KMT2AUSP30GPR119
SCHEMBL18154352 0.76 HSD11B1 (0.48) HSD11B1MEN1KMT2AJAK2JAK1
SCHEMBL7425320 0.76 KDM4E (0.38) HSD11B1GPR119KDM4ECYP2D6SLC6A2
SCHEMBL5500431 0.75 HSD11B1 (0.39) HSD11B1MEN1KMT2AJAK2JAK1
SCHEMBL18585599 0.75 HSD11B1 (0.44) HSD11B1JAK2JAK1CCR5NR1H4

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-113227068-B GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-06-13 CN disclosed
CN-113227068-A GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2021-08-06 CN disclosed