Spermine

Spermine

SCHEMBL25409776

CC(=O)NCCCCNCCCN.NCCCNCCCCNCCCN

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAOX Q6QHF9 4/20 0.76
▸ KDM4E B2RXH2 1/20 0.62
▸ MAPK1 P28482 1/20 0.62
▸ HIF1A Q16665 1/20 0.62
▸ CA12 O43570 2/20 0.56
▸ F13A1 P00488 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ CYP1A2 P05177 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ CA4 P22748 2/20 0.56
▸ CA6 P23280 2/20 0.56
▸ CA5A P35218 2/20 0.56
▸ THPO P40225 2/20 0.56
▸ CA7 P43166 2/20 0.56
▸ CA9 Q16790 2/20 0.56
▸ CA14 Q9ULX7 2/20 0.56
▸ CA5B Q9Y2D0 2/20 0.56
▸ CASP2 P42575 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56

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
SCHEMBL183049 1.00 PAOX (0.76) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL193116 0.98 PAOX (0.73) PAOXKDM4EMAPK1HIF1ACA12
Spermidine SCHEMBL10954114 0.98 PAOX (0.80) PAOXKDM4EMAPK1HIF1ACA12
Hydrochloric Acid SCHEMBL17292784 0.96 PAOX (0.70) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL25229942 0.96 PAOX (0.77) PAOXKDM4EMAPK1HIF1ACA12
Hydrochloric Acid SCHEMBL27789136 0.96 PAOX (0.70) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL22171088 0.96 PAOX (0.69) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL22171096 0.96 PAOX (0.69) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL183048 0.94 PAOX (0.80) PAOXKDM4EMAPK1HIF1ACA12
SCHEMBL14259519 0.94 PAOX (0.67) PAOXKDM4EMAPK1HIF1ACA12

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
EP-4216726-A1 PROBIOTIC BACILLUS COMPOSITIONS AND METHODS OF USE Biomedit, LLC (US) 2023-08-02 — — EP disclosed
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