SCHEMBL2532487

SCHEMBL2532487

COCCN(C)c1cc(C(=O)O)nc2c(N3CCOCC3)nc(-n3ccnc3)nc12

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 20/20 0.61

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
SCHEMBL2532352 0.93 PIK3CA (0.53) PIK3CA
SCHEMBL2537603 0.82 PIK3CA (0.44) PIK3CA
SCHEMBL12220414 0.81 PIK3CA (0.41) PIK3CA
SCHEMBL2532701 0.81 PIK3CA (0.41) PIK3CA
SCHEMBL2534623 0.79 PIK3CA (0.54) PIK3CA
SCHEMBL13257330 0.77 PIK3CA (0.87) PIK3CA
SCHEMBL2532730 0.77 PIK3CA (0.52) PIK3CA
SCHEMBL2535025 0.76 PIK3CA (0.42) PIK3CA
SCHEMBL13258338 0.76 PIK3CA (1.00) PIK3CA
SCHEMBL13257278 0.76 PIK3CA (1.00) PIK3CA

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-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO SA (CH) 2011-10-20 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-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES PIK3CA, PIK3CD, PIK3CG PIK3CA 1/4885

“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.