SCHEMBL14504257

SCHEMBL14504257

C=CCN(C(=O)NCc1ccccc1)N1CC(=O)N2[C@@H](Cc3ccc(NC)cc3)C(=O)N(Cc3cccc4ccccc34)C[C@@H]21

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 5/20 0.56
▸ CTNNB1 P35222 2/20 0.55
▸ TCF7 P36402 2/20 0.55
▸ BCL9 O00512 1/20 0.55
▸ TCF4 P15884 1/20 0.55
▸ CREBBP Q92793 1/20 0.55
▸ CYP3A4 P08684 14/20 0.49

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
SCHEMBL13774165 0.95 CLPP (0.51) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13773477 0.94 CLPP (0.62) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14504258 0.94 CYP3A4 (0.51) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13774033 0.94 CYP3A4 (0.51) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13774277 0.93 CLPP (0.49) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14503903 0.93 CLPP (0.54) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14309332 0.93 CLPP (0.55) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13430525 0.92 CTNNB1 (0.64) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14504255 0.92 CLPP (0.47) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14310077 0.92 CLPP (0.47) CLPPCTNNB1TCF7BCL9TCF4

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-20070129353-A1 Alpha-helix mimetics and method relating to the treatment of cancer stem cells INSTITUTE FOR CHEMICAL GENOMICS 2007-06-07 — — 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-20070129353-A1 Alpha-helix mimetics and method relating to the treatment of cancer stem cells MCL1, HNF4A, THPO CLPP 2482/4885CTNNB1 101/4885TCF7 76/4885

“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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