SCHEMBL13977597

SCHEMBL13977597

CC(C)(C)OC(=O)NCC1=NN=C(CNC(=O)OC(C)(C)C)NN1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
GFER P55789 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
PARP1 P09874 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
KDM4A O75164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CACNA1H O95180 1/20 0.40
CACNA1B Q00975 1/20 0.40
CACNA1C Q13936 1/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
NAMPT P43490 1/20 0.39
HTT P42858 1/20 0.38
BCHE P06276 1/20 0.38
CYP1A2 P05177 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL18646412 0.80 KDM4E (0.45) KDM4ELMNAGFERL3MBTL1PARP1
SCHEMBL13977598 0.76 KDM4E (0.49) KDM4ELMNAGFERL3MBTL1TDP1
SCHEMBL26328790 0.73 KDM4E (0.42) KDM4ELMNAGFERL3MBTL1PARP1
SCHEMBL5019115 0.72 LMNA (0.50) KDM4ELMNAGFERL3MBTL1PARP1
SCHEMBL13055397 0.72 KDM4A (0.51) KDM4ELMNAL3MBTL1TDP1KDM4A
SCHEMBL22535987 0.72 TDP1 (0.46) KDM4ELMNAGFERL3MBTL1TDP1
SCHEMBL572016 0.72 TDP1 (0.46) KDM4ELMNAGFERL3MBTL1TDP1
SCHEMBL3180689 0.72 L3MBTL1 (0.61) L3MBTL1TDP1KDM4ANPSR1GAA
SCHEMBL17107898 0.71 L3MBTL1 (0.50) KDM4ELMNAGFERL3MBTL1PARP1
SCHEMBL22535990 0.70 TDP1 (0.44) KDM4ELMNAGFERL3MBTL1TDP1

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-11857636-B2 Bio-orthogonal drug activation TAGWORKS PHARMACEUTICALS B.V. (NL) 2024-01-02 US disclosed
EP-3973993-A1 BIO-ORTHOGONAL DRUG ACTIVATION Tagworks Pharmaceuticals B.V. (NL) 2022-03-30 EP disclosed
EP-2709666-B1 BIO-ORTHOGONAL DRUG ACTIVATION KONINKLIJKE PHILIPS NV (NL) 2021-07-14 EP disclosed
US-20170143840-A1 BIO-ORTHOGONAL DRUG ACTIVATION TAGWORKS PHARMACEUTICALS B.V. (NL) 2017-05-25 US disclosed
US-20170143840-A1 BIO-ORTHOGONAL DRUG ACTIVATION TAGWORKS PHARMACEUTICALS B.V. (NL) 2017-05-25 US disclosed
US-9421274-B2 Bio-orthogonal drug activation KONINKLIJKE PHILIPS N.V. (NL) 2016-08-23 US disclosed
US-9421274-B2 Bio-orthogonal drug activation KONINKLIJKE PHILIPS N.V. (NL) 2016-08-23 US disclosed
US-20160151505-A1 BIO-ORTHOGONAL DRUG ACTIVATION KONINKLIJKE PHILIPS N.V. (NL) 2016-06-02 US disclosed
US-20160151505-A1 BIO-ORTHOGONAL DRUG ACTIVATION KONINKLIJKE PHILIPS N.V. (NL) 2016-06-02 US disclosed
WO-2012156920-A1 BIO-ORTHOGONAL DRUG ACTIVATION KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2012-11-22 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 (3 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-20170143840-A1 BIO-ORTHOGONAL DRUG ACTIVATION JMJD7, KIT, PAICS KDM4E 1403/4885LMNA 4539/4885GFER 2469/4885
US-11857636-B2 Bio-orthogonal drug activation JMJD7, KIT, PAICS KDM4E 1403/4885LMNA 4539/4885GFER 2469/4885
US-20160151505-A1 BIO-ORTHOGONAL DRUG ACTIVATION JMJD7, KIT, PAICS KDM4E 1403/4885LMNA 4539/4885GFER 2469/4885

“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.