SCHEMBL1486566

SCHEMBL1486566

CC(C)(C)N(CCCCNc1c([N+](=O)[O-])cnc2ccc(OCc3ccccc3)cc12)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NMT1 P30419 3/20 0.40
NMT2 O60551 2/20 0.40
BACE1 P56817 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL1486564 1.00 MAPT (0.41) MAPTTP53SMN1; SMN2NMT1NMT2
SCHEMBL1486617 0.94 BCL2 (0.38) MAPTBACE1
SCHEMBL1486614 0.94 BCL2 (0.38) MAPTBACE1
SCHEMBL1962206 0.88 MAPT (0.40) MAPTBACE1
SCHEMBL1486511 0.87 NMT1 (0.44) MAPTTP53SMN1; SMN2NMT1NMT2
SCHEMBL2507712 0.85 CHRM2 (0.48) MAPTALDH1A1LMNAHPGD
SCHEMBL2507709 0.85 CHRM2 (0.48) MAPTALDH1A1LMNAHPGD
SCHEMBL1486588 0.85 MAPT (0.46) MAPTTP53SMN1; SMN2NMT1NMT2
SCHEMBL1486586 0.85 MAPT (0.46) MAPTTP53SMN1; SMN2NMT1NMT2
SCHEMBL1486503 0.84 MAPT (0.43) MAPTTP53SMN1; SMN2NMT1NMT2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263594-B2 Aryloxy and arylalkyleneoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-09-11 US disclosed
US-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY 2011-06-16 US disclosed
US-7897597-B2 Aryloxy and arylalkyleneoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 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-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES IL2, IFNG, IRF3 MAPT 4760/4885TP53 231/4885SMN1; SMN2 3907/4885

“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.