SCHEMBL12901296

SCHEMBL12901296

CC(=O)N(CCCN)CCCCN(CCCN(CCCN)C(C)=O)C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 4/20 0.39
LMNA P02545 3/20 0.38
USP2 O75604 1/20 0.38
CHRM2 P08172 1/20 0.37
KDM4A O75164 1/20 0.36
HIF1A Q16665 1/20 0.36
TET2 Q6N021 1/20 0.36
DOHH Q9BU89 1/20 0.36
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GABRR3 A8MPY1 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
HDAC3 O15379 1/20 0.33
GABBR2 O75899 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
GABRA1 P14867 1/20 0.33
TSHR P16473 1/20 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
SCHEMBL29730915 0.98 PAOX (0.41) PAOXLMNAUSP2CHRM2KDM4A
SCHEMBL6943345 0.95 PAOX (0.44) PAOXLMNAUSP2CHRM2KDM4A
Hydrochloric Acid SCHEMBL19924865 0.93 PAOX (0.41) PAOXLMNAUSP2CHRM2KDM4A
SCHEMBL6901460 0.92 PAOX (0.34) PAOXLMNAUSP2CHRM2KDM4A
SCHEMBL6898516 0.87 PAOX (0.39) PAOXLMNAUSP2CHRM2KDM4A
SCHEMBL6546705 0.85 CA12 (0.47) PAOXCHRM2TSHRKMT2ACA12
SCHEMBL5507927 0.84 PAOX (0.55) PAOXLMNAKDM4ESMN1; SMN2CYP1A2
SCHEMBL13717326 0.84 CA12 (0.42) PAOXLMNAKDM4AHIF1ATET2
SCHEMBL8381768 0.83 PAOX (0.43) PAOXCHRM2KDM4AHIF1ATET2
SCHEMBL13737325 0.82 PAOX (0.41) PAOXLMNACHRM2KDM4AHIF1A

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
US-20110045027-A1 Adjuvant GLAXO GROUP LIMITED (GB) 2011-02-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110045027-A1 Adjuvant TLR3, TLR9, TLR7 PAOX 1262/4885LMNA 3814/4885USP2 3026/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.