SCHEMBL26149396

SCHEMBL26149396

CC(=O)N(C)C1CCN(C2CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 1/20 0.42
L3MBTL3 Q96JM7 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DPP4 P27487 3/20 0.38
DPP8 Q6V1X1 1/20 0.37
LMNA P02545 1/20 0.36
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
CCR5 P51681 1/20 0.34
KCNH2 Q12809 2/20 0.33
VNN1 O95497 1/20 0.33
MCHR1 Q99705 1/20 0.33
MAP4K4 O95819 1/20 0.33
ALOX15 P16050 1/20 0.33
POLB P06746 1/20 0.33
HRH3 Q9Y5N1 2/20 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
SCHEMBL19658595 0.92 PDE7A (0.43) PDE7AL3MBTL3L3MBTL1DPP4DPP8
SCHEMBL176112 0.85 LMNA (0.39) PDE7AL3MBTL3L3MBTL1DPP4DPP8
SCHEMBL14302742 0.81 HRH3 (0.38) DPP4DPP8KCNH2MCHR1MAP4K4
SCHEMBL16365471 0.81 HTR6 (0.39) PDE7AL3MBTL3L3MBTL1DPP4DPP8
SCHEMBL26149354 0.80 L3MBTL3 (0.36) PDE7AL3MBTL3L3MBTL1LMNAKDM4E
SCHEMBL26149352 0.79 CCR5 (0.39) PDE7AL3MBTL3L3MBTL1DPP4CCR5
SCHEMBL805270 0.79 LMNA (0.51) L3MBTL1DPP4DPP8LMNAKDM4E
SCHEMBL12010866 0.79 MCHR1 (0.47) L3MBTL1LMNAALDH1A1KCNH2MCHR1
SCHEMBL27736476 0.78 L3MBTL3 (0.36) PDE7AL3MBTL3L3MBTL1LMNAKDM4E
SCHEMBL13207185 0.78 MCHR1 (0.42) L3MBTL3L3MBTL1DPP4DPP8CCR5

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
WO-2023083330-A1 DRAK2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 百极优棠(广东)医药科技有限公司 2023-05-19 WO disclosed