SCHEMBL13952181

SCHEMBL13952181

CCC(CC)C1CCCC[C@@H]1N

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SHBG P04278 1/20 0.36

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
SCHEMBL13462490 1.00 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13952341 1.00 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13952290 1.00 THRB (0.41) THRBMEN1KMT2ASHBG
SCHEMBL13716849 0.84 DPP4 (0.34) THRBMEN1KMT2A
SCHEMBL25972352 0.83
SCHEMBL24742714 0.79 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL9439852 0.79 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL9154707 0.79 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL2451853 0.79 THRB (0.39) THRBMEN1KMT2ASHBG
SCHEMBL9402900 0.79 THRB (0.39) THRBMEN1KMT2ASHBG

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-20090054472-A1 Pyrazolopyrimidine Derivatives or Pharmaceutically Acceptable Salts Thereof TEIJIN PHARMA LIMITED (JP) 2009-02-26 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-20090054472-A1 Pyrazolopyrimidine Derivatives or Pharmaceutically Acceptable Salts Thereof MAPKAPK2, MAPKAPK5, MAPKAPK3 THRB 3409/4885MEN1 1213/4885KMT2A 979/4885

“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.