SCHEMBL13745342

SCHEMBL13745342

CCCN1CC(=O)N2C(CN(CCC(C)C)C(=O)[C@@H]2CC(C)C)N1C(=O)NCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CLPP Q16740 1/20 0.52
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 18/20 0.44

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
SCHEMBL12032867 0.95 CLPP (0.53) CLPPALDH1A1CYP3A4
SCHEMBL13744940 0.92 ALDH1A1 (0.46) CLPPALDH1A1CYP3A4
SCHEMBL13744991 0.91 ALDH1A1 (0.44) CLPPALDH1A1CYP3A4
SCHEMBL744591 0.90 CLPP (0.55) CLPPALDH1A1CYP3A4
SCHEMBL13745341 0.90 CYP3A4 (0.55) CYP3A4
SCHEMBL749108 0.89 CLPP (0.50) CLPPALDH1A1CYP3A4
SCHEMBL13184823 0.89 CLPP (0.51) CLPPALDH1A1CYP3A4
SCHEMBL13369151 0.89 CLPP (0.53) CLPPCYP3A4
SCHEMBL13369105 0.88 CYP3A4 (0.51) CYP3A4
SCHEMBL12037885 0.87 CLPP (0.51) CLPPCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215783-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION CHOONGWAE PHARMA CORPORATION (KR) 2009-08-27 US disclosed
US-20090215783-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION CHOONGWAE PHARMA CORPORATION (KR) 2009-08-27 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-20090215783-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION MYLK2, TNNC1, MYH2 CLPP 3986/4885ALDH1A1 648/4885CYP3A4 4483/4885

“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.