SCHEMBL19340291

SCHEMBL19340291

CC(C)(C)OC(=O)NCCCCCN(CCCCN(CCCN)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.57
TDP1 Q9NUW8 1/20 0.55
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
CA1 P00915 7/20 0.46
CA2 P00918 7/20 0.46
CA12 O43570 6/20 0.46
CA9 Q16790 6/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
PAOX Q6QHF9 2/20 0.39
STK17B O94768 1/20 0.38
STK17A Q9UEE5 1/20 0.38
CYP3A4 P08684 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL5919555 0.99 CA14 (0.58) CA14TDP1MAOAMAOBCA1
SCHEMBL7264039 0.96 CA14 (0.58) CA14TDP1MAOAMAOBCA1
SCHEMBL7270004 0.96 CA14 (0.58) CA14TDP1MAOAMAOBCA1
SCHEMBL3472122 0.96 CA14 (0.62) CA14TDP1MAOAMAOBCA1
SCHEMBL1919913 0.94 CA14 (0.60) CA14TDP1MAOAMAOBCA1
SCHEMBL4370840 0.94 CA14 (0.59) CA14TDP1MAOAMAOBCA1
SCHEMBL18258336 0.93 CA14 (0.53) CA14TDP1MAOAMAOBCA1
SCHEMBL7631999 0.93 CA14 (0.62) CA14TDP1MAOAMAOBCA1
SCHEMBL13055412 0.93 CA14 (0.64) CA14TDP1MAOAMAOBCA1
SCHEMBL10181287 0.92 CA14 (0.53) CA14TDP1MAOAMAOBCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170260184-A1 TOLL-LIKE RECEPTOR-7 AND -8 MODULATORY 1H IMIDAZOQUINOLINE DERIVED COMPOUNDS UNIV KANSAS (US) 2017-09-14 US disclosed
US-20170260184-A1 TOLL-LIKE RECEPTOR-7 AND -8 MODULATORY 1H IMIDAZOQUINOLINE DERIVED COMPOUNDS UNIV KANSAS (US) 2017-09-14 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-20170260184-A1 TOLL-LIKE RECEPTOR-7 AND -8 MODULATORY 1H IMIDAZOQUINOLINE DERIVED COMPOUNDS TLR7, TLR8, TLR3 CA14 4708/4885TDP1 1837/4885MAOA 3924/4885

“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.