SCHEMBL30572303

SCHEMBL30572303

C#CCN1CCN(CC23CC4CC(CC(C4)C2)C3)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 2/20 0.37
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
HSD11B1 P28845 1/20 0.35
GRIN2D O15399 3/20 0.34
GRIN3B O60391 3/20 0.34
GRIN1 Q05586 3/20 0.34
GRIN2A Q12879 3/20 0.34
GRIN2B Q13224 3/20 0.34
GRIN2C Q14957 3/20 0.34
GRIN3A Q8TCU5 3/20 0.34
BPTF Q12830 1/20 0.33
MAOB P27338 3/20 0.32
HTT P42858 1/20 0.32
MAOA P21397 3/20 0.31
EPHX2 P34913 1/20 0.31
L3MBTL1 Q9Y468 1/20 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
SCHEMBL28223160 0.75 KDM4E (0.58) KDM4EALDH1A1CYP11B1CYP11B2HSD11B1
SCHEMBL6313781 0.73 KDM4E (0.56) KDM4EALDH1A1CYP11B1CYP11B2HSD11B1
SCHEMBL26831741 0.72 LMNA (0.40) MAOBMAOA
SCHEMBL15870032 0.72 LMNA (0.40) MAOBMAOA
SCHEMBL24247404 0.72 LMNA (0.40) MAOBMAOA
SCHEMBL1769287 0.72
SCHEMBL6313788 0.71 KDM4E (0.58) KDM4EALDH1A1CYP11B1CYP11B2HSD11B1
SCHEMBL24352139 0.71 KDM4E (0.96) KDM4EALDH1A1CYP11B1CYP11B2GRIN2D
SCHEMBL6313783 0.71 KDM4E (0.58) KDM4EALDH1A1CYP11B1CYP11B2HSD11B1
SCHEMBL2555430 0.66 GRIN2D (0.46) KDM4EALDH1A1GRIN2DGRIN3BGRIN1

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-2023151635-A1 COMPOUND BASED ON QUINAZOLINE-SUBSTITUTED GLUTARIMIDE SKELETON AND USE THEREOF 标新生物医药科技(上海)有限公司 2023-08-17 WO disclosed