SCHEMBL25817406

SCHEMBL25817406

CC(=O)NCCCCN(C)CCOCCOCCNC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
PAOX Q6QHF9 3/20 0.41
DRD3 P35462 1/20 0.40
ADRA1A P35348 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ACHE P22303 2/20 0.36
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35

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
SCHEMBL25817389 0.98 KDM4E (0.48) KDM4EMAPK1HIF1APAOXDRD3
SCHEMBL25817398 0.97 KDM4E (0.52) KDM4EMAPK1HIF1APAOXDRD3
SCHEMBL25816846 0.92 MEN1 (0.44) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25817408 0.92 MEN1 (0.44) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25816562 0.90 SMN1; SMN2 (0.44) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25816847 0.88 SMN1; SMN2 (0.42) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25817411 0.86 SMN1; SMN2 (0.41) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25816564 0.85 SMN1; SMN2 (0.41) KDM4EMAPK1HIF1AMEN1KMT2A
SCHEMBL25816703 0.83 MEN1 (0.53) DRD3MEN1KMT2AACHE
SCHEMBL25837278 0.82 KDM4E (0.70) KDM4EMAPK1HIF1APAOXDRD3

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-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed