SCHEMBL15730286

SCHEMBL15730286

CC(=O)OCC(CN1C(=O)N=NC1=O)OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
GAA P10253 2/20 0.37
AR P10275 1/20 0.36
POLB P06746 3/20 0.35
MAPT P10636 1/20 0.35
PRKCA P17252 3/20 0.34
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.33
KDM4E B2RXH2 1/20 0.31

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
Triacetin SCHEMBL3870 0.74 TDP1 (0.56) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL821340 0.74 TDP1 (0.56) TDP1GAAARPRKCAKMT2A
SCHEMBL3975559 0.73 SLC18A3 (0.43) TDP1GAAARPOLBMAPT
Triacetin SCHEMBL31301065 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL16446056 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL31035933 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL4367394 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL8012678 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL30661717 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A
Triacetin SCHEMBL16445622 0.72 TDP1 (0.54) TDP1GAAARPRKCAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 US disclosed
US-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 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-20140141034-A1 TYROSINE LIGATION PROCESS ACP1, LTK, TTL TDP1 1088/4885GAA 406/4885AR 2718/4885

“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.