SCHEMBL6140233

SCHEMBL6140233

COc1cc([N+](=O)[O-])ccc1N1C(=O)CCCC1=O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.64
POLB P06746 1/20 0.64
APEX1 P27695 1/20 0.64
CASP6 P55212 1/20 0.64
CTDSP1 Q9GZU7 1/20 0.64
HTT P42858 2/20 0.51
MAPT P10636 9/20 0.48
LMNA P02545 5/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 3/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 1/20 0.46
NR1H4 Q96RI1 1/20 0.45

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
SCHEMBL5370534 0.94 TDP1 (0.56) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL5375674 0.83 NR1H4 (0.55) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL6140258 0.81 TDP1 (0.69) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL6140946 0.80 TDP1 (0.71) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL6140264 0.78 CASP6 (0.69) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL32690181 0.78 TDP1 (1.00) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL1928415 0.78 ALDH1A1 (0.64) HTTMAPTLMNAMEN1KMT2A
SCHEMBL6140454 0.78 POLB (0.69) TDP1POLBAPEX1CASP6CTDSP1
SCHEMBL16592564 0.78 RECQL (0.62) CASP6HTTMAPTLMNAMEN1
SCHEMBL15725834 0.78 ALDH1A1 (0.64) TDP1HTTMAPTLMNAMEN1

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-20050182260-A1 Process for the preparation of cyclic imides in the presence of polyphosphoric acid MERCK PATENT GMBH (DE) 2005-08-18 US disclosed
EP-1506173-A1 METHOD FOR PRODUCING CYCLIC IMIDES IN THE PRESENCE OF POLYPHOSPHORIC ACID MERCK PATENT GmbH (DE) 2005-02-16 EP disclosed
WO-2003097600-A1 METHOD FOR PRODUCING CYCLIC IMIDES IN THE PRESENCE OF POLYPHOSPHORIC ACID MERCK PATENT GMBH (DE) 2003-11-27 WO 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-20050182260-A1 Process for the preparation of cyclic imides in the presence of polyphosphoric acid PPIP5K2, ITPA, IPMK TDP1 2026/4885POLB 1147/4885APEX1 1525/4885

“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.