SCHEMBL17830248

SCHEMBL17830248

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.47
RAD51 Q06609 2/20 0.42
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
APEX1 P27695 1/20 0.38
HPGD P15428 2/20 0.38
PKM P14618 1/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 4/20 0.37
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL19726904 0.93 ENPP2 (0.41) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL17830396 0.92 ENPP2 (0.48) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL19713069 0.89 ENPP2 (0.53) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL17830394 0.89 ENPP2 (0.53) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL19713046 0.88 RAD51 (0.39) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL17830247 0.87 ENPP2 (0.51) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL19726902 0.86 KDM4E (0.37) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL19726903 0.85 ENPP2 (0.42) ENPP2RAD51RAB9ASMN1; SMN2KDM4E
SCHEMBL17830249 0.84 ENPP2 (0.53) ENPP2RAD51RAB9AKDM4EAPEX1
SCHEMBL19713037 0.84 ENPP2 (0.53) ENPP2RAD51RAB9AKDM4EAPEX1

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 225/4885RAD51 35/4885RAB9A 2826/4885
US-10927075-B2 Compositions and methods relating to the treatment of cancer, autoimmune disease, and neurodegenerative disease OGG1, MGMT, TDP1 ENPP2 225/4885RAD51 35/4885RAB9A 2826/4885

“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.