SCHEMBL17830396

SCHEMBL17830396

CCC(=O)NS(=O)(=O)c1cc(NC(C)=O)ccc1/C=C/c1ccc(NC(=S)NC(C)C)cc1S(=O)(=O)NC(=O)CC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.43
RAD51 Q06609 2/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 3/20 0.41
APEX1 P27695 1/20 0.39
PKM P14618 1/20 0.39
POLB P06746 1/20 0.38
NR4A1 P22736 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
PLK1 P53350 1/20 0.36

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
SCHEMBL19726903 0.93 ENPP2 (0.42) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL17830248 0.92 ENPP2 (0.47) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL17830394 0.91 ENPP2 (0.53) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL19713069 0.91 ENPP2 (0.53) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL19713083 0.90 RAD51 (0.40) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL17830247 0.89 ENPP2 (0.51) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL17830249 0.86 ENPP2 (0.53) ENPP2RAD51ALDH1A1KDM4ERAB9A
SCHEMBL19713037 0.86 ENPP2 (0.53) ENPP2RAD51ALDH1A1KDM4ERAB9A
SCHEMBL19726904 0.86 ENPP2 (0.41) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E
SCHEMBL19726898 0.85 KDM4E (0.39) ENPP2SMN1; SMN2RAD51ALDH1A1KDM4E

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-10927075-B2 Compositions and methods relating to the treatment of cancer, autoimmune disease, and neurodegenerative disease THE JACKSON LABORATORY (US) 2021-02-23 US disclosed
US-20170362172-A1 COMPOSITIONS AND METHODS RELATING TO THE TREATMENT OF CANCER, AUTOIMMUNE DISEASE, AND NEURODEGENERATIVE DISEASE THE JACKSON LABORATORY (US) 2017-12-21 US disclosed
WO-2016094897-A1 COMPOSITIONS AND METHODS RELATING TO THE TREATMENT OF CANCER, AUTOIMMUNE DISEASE, AND NEURODEGENERATIVE DISEASE THE JACKSON LABORATORY (US) 2016-06-16 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 (2 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-20170362172-A1 COMPOSITIONS AND METHODS RELATING TO THE TREATMENT OF CANCER, AUTOIMMUNE DISEASE, AND NEURODEGENERATIVE DISEASE OGG1, MGMT, TDP1 ENPP2 225/4885SMN1; SMN2 11/4885RAD51 35/4885
US-10927075-B2 Compositions and methods relating to the treatment of cancer, autoimmune disease, and neurodegenerative disease OGG1, MGMT, TDP1 ENPP2 225/4885SMN1; SMN2 11/4885RAD51 35/4885

“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.