SCHEMBL10236170

SCHEMBL10236170

Cc1ccc(N2CCN(C(=O)CN3CCC(C(=O)Nc4ccc(O)c(Cl)c4)C3)CC2)cc1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 0.84
▸ RPS6KA3 P51812 1/20 0.84

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
SCHEMBL10236187 0.97 MAPK1 (0.86) MAPK1RPS6KA3
SCHEMBL10236150 0.93 MAPK1 (0.78) MAPK1RPS6KA3
SCHEMBL10236146 0.91 MAPK1 (0.87) MAPK1RPS6KA3
SCHEMBL10236105 0.91 MAPK1 (0.87) MAPK1RPS6KA3
SCHEMBL10236168 0.91 MAPK1 (1.00) MAPK1RPS6KA3
SCHEMBL14452909 0.91 MAPK1 (1.00) MAPK1RPS6KA3
SCHEMBL7878839 0.91 MAPK1 (1.00) MAPK1RPS6KA3
SCHEMBL13118895 0.91 MAPK1 (1.00) MAPK1RPS6KA3
SCHEMBL10236149 0.91 MAPK1 (0.85) MAPK1RPS6KA3
SCHEMBL7874415 0.90 MAPK1 (0.87) MAPK1RPS6KA3

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-20120114739-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS MERCK SHARP & DOHME LLC 2012-05-10 — — 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-20120114739-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS MTOR, RICTOR, RPTOR MAPK1 277/4885RPS6KA3 14/4885

“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.

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