SCHEMBL11959586

SCHEMBL11959586

C#CC(=O)NCCN(CCNC(=O)C#C)C(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA14 Q9ULX7 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC1 Q13547 2/20 0.34
▸ HDAC2 Q92769 2/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34
▸ CA12 O43570 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ CKS1B P61024 1/20 0.30
▸ SKP1 P63208 1/20 0.30
▸ SKP2 Q13309 1/20 0.30
▸ CA7 P43166 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL13857545 0.98 CA14 (0.51) CA14TDP1MEN1GAAKMT2A
SCHEMBL15569713 0.80 CA14 (0.54) CA14TDP1MEN1GAAKMT2A
SCHEMBL13055403 0.80 CA14 (0.54) CA14TDP1MEN1GAAKMT2A
SCHEMBL15295664 0.79 CA14 (0.45) CA14TDP1MEN1GAAKMT2A
SCHEMBL13055399 0.78 CA14 (0.53) CA14TDP1MEN1GAAKMT2A
SCHEMBL13055414 0.78 CA14 (0.53) CA14TDP1MEN1GAAKMT2A
SCHEMBL13055411 0.78 CA14 (0.53) CA14TDP1MEN1GAAKMT2A
SCHEMBL13055400 0.77 CA14 (0.64) CA14TDP1MEN1GAAKMT2A
SCHEMBL17532668 0.77 CA14 (0.51) CA14TDP1MEN1GAAKMT2A
SCHEMBL12227587 0.76 TDP1 (0.56) TDP1MEN1GAAKMT2ACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501478-B2 Trehalose click polymers for delivery of biologically active molecules UNIVERSITY OF CINCINNATI (US) 2013-08-06 — — US disclosed
US-8372966-B2 Oligonucleotide decoys and methods of use UNIVERSITY OF CINCINNATI (US) 2013-02-12 — — US disclosed
US-20120270927-A1 Polyamides For Nucleic Acid Delivery UNIVERSITY OF CINCINNATI 2012-10-25 — — US disclosed
US-8236280-B2 Polyamides for nucleic acid delivery UNIVERSITY OF CINCINNATI (US) 2012-08-07 — — US disclosed
US-8034619-B2 Polyamides for nucleic acid delivery UNIVERSITY OF CINCINNATI (US) 2011-10-11 — — US disclosed
US-20110183417-A1 POLYAMIDES FOR NUCLEIC ACID DELIVERY UNIVERSITY OF CINCINNATI 2011-07-28 — — US disclosed
US-7927873-B2 Polyamides for nucleic acid delivery UNIVERSITY OF CINCINNATI (US) 2011-04-19 — — US disclosed
US-20090124534-A1 Trehalose Click Polymers for Delivery of Biologically Active Molecules UNIVERSITY OF CINCINNATI (US) 2009-05-14 — — US disclosed
US-20090105115-A1 POLYAMIDES FOR NUCLEIC ACID DELIVERY UNIVERSITY OF CINCINNATI 2009-04-23 — — US disclosed
US-20090099108-A1 OLIGONUCLEOTIDE DECOYS AND METHODS OF USE UNIVERSITY OF CINCINNATI 2009-04-16 — — 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 (4 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-20090105115-A1 POLYAMIDES FOR NUCLEIC ACID DELIVERY TLR3, TLR9, TLR6 CA14 221/4885TDP1 973/4885MEN1 4001/4885
US-20090124534-A1 Trehalose Click Polymers for Delivery of Biologically Active Molecules TREH, TK1, DDOST CA14 1240/4885TDP1 571/4885MEN1 1648/4885
US-20120270927-A1 Polyamides For Nucleic Acid Delivery TLR3, TLR9, DCLRE1A CA14 383/4885TDP1 803/4885MEN1 3440/4885
US-20090099108-A1 OLIGONUCLEOTIDE DECOYS AND METHODS OF USE NFKB2, IKBKB, NFKBIA CA14 3846/4885TDP1 824/4885MEN1 4766/4885

“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.

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