SCHEMBL16197989

SCHEMBL16197989

NCCCCCCNc1nc2nc[nH]c2c(=O)[nH]1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.77
GDA Q9Y2T3 1/20 0.51

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
SCHEMBL8196752 0.99 XDH (0.76) XDHGDA
SCHEMBL17274775 0.95 XDH (0.76) XDHGDA
SCHEMBL9806979 0.89 XDH (0.71) XDHGDA
SCHEMBL5935074 0.89 XDH (0.78) XDHGDA
SCHEMBL4384744 0.87 XDH (1.00) XDHGDA
SCHEMBL27959660 0.87 XDH (0.77) XDHGDA
SCHEMBL8535457 0.87 XDH (1.00) XDHGDA
Hydrochloric Acid SCHEMBL258899 0.86 XDH (0.97) XDHGDA
SCHEMBL249649 0.85 XDH (1.00) XDHGDA
Hydrochloric Acid SCHEMBL30610398 0.85 XDH (0.95) XDHGDA

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
EP-2989112-B1 MODIFIED G-QUADRUPLEX NANOPARTICLES UNIV NANYANG TECH (SG) 2021-09-22 EP disclosed
US-20160310519-A1 MODIFIED G-QUADRUPLEX NANOPARTICLES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-10-27 US disclosed
EP-2989112-A1 MODIFIED G-QUADRUPLEX NANOPARTICLES Nanyang Technological University (SG) 2016-03-02 EP disclosed
WO-2014175836-A1 MODIFIED G-QUADRUPLEX NANOPARTICLES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2014-10-30 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-20160310519-A1 MODIFIED G-QUADRUPLEX NANOPARTICLES NCL, G3BP1, NPM1 XDH 3185/4885GDA 27/4885

“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.