SCHEMBL14505249

SCHEMBL14505249

C=CCN(C(=O)NCc1ccc(Cl)c(Cl)c1)N1CC(=O)N2[C@@H](Cc3ccc(NC(=O)OCc4ccccc4)cc3)C(=O)N(Cc3cccc4ccccc34)C[C@@H]21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 2/20 0.47
▸ TCF7 P36402 2/20 0.47
▸ CLPP Q16740 2/20 0.47
▸ BCL9 O00512 1/20 0.47
▸ TCF4 P15884 1/20 0.47
▸ CREBBP Q92793 1/20 0.47
▸ CYP3A4 P08684 17/20 0.43

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
SCHEMBL14319198 0.94 CTNNB1 (0.53) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14308165 0.92 CLPP (0.54) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14308172 0.91 CLPP (0.47) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14319407 0.91 CLPP (0.47) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14319368 0.91 CTNNB1 (0.50) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14319193 0.91 CLPP (0.47) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14505250 0.90 CYP3A4 (0.54) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14319196 0.90 CLPP (0.49) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL13773536 0.90 CTNNB1 (0.54) CTNNB1TCF7CLPPBCL9TCF4
SCHEMBL14319393 0.90 CLPP (0.47) CTNNB1TCF7CLPPBCL9TCF4

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 CTNNB1 101/4885TCF7 76/4885CLPP 2482/4885

“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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