SCHEMBL19420751

SCHEMBL19420751

CSC(C)(C)[C@H](Nc1nc(Cl)nc2[nH]cnc12)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.33

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
SCHEMBL179394 0.88 XDH (0.37) XDH
SCHEMBL179393 0.88 XDH (0.37) XDH
SCHEMBL179366 0.88 XDH (0.37) XDH
SCHEMBL179382 0.81 XDH (0.38) XDH
SCHEMBL179370 0.81 XDH (0.38) XDH
SCHEMBL179419 0.81 XDH (0.38) XDH
SCHEMBL16356354 0.79 XDH (0.38) XDH
SCHEMBL19778933 0.79 XDH (0.34) XDH
SCHEMBL12187032 0.78 XDH (0.40) XDH
SCHEMBL12186859 0.78 XDH (0.40) XDH

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281614-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC 2017-10-05 US 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-20170281614-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, PIK3CG, PIK3CB XDH 1361/4885

“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.