SCHEMBL14504752

SCHEMBL14504752

COc1ccc(CNC(=O)N(C)N2CC(=O)N3[C@@H](c4ccccc4)C(=O)N(Cc4cccc5ccccc45)C[C@@H]32)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 15/20 0.53
▸ CTNNB1 P35222 2/20 0.44
▸ TCF7 P36402 2/20 0.44
▸ BCL9 O00512 1/20 0.44
▸ TCF4 P15884 1/20 0.44
▸ CREBBP Q92793 1/20 0.44
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40

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
SCHEMBL14309354 0.93 CLPP (0.51) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14309320 0.91 CLPP (0.46) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13773523 0.91 CLPP (0.54) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13773552 0.90 MEN1 (0.51) CLPPMEN1KMT2ACYP3A4
SCHEMBL14309311 0.90 CLPP (0.52) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL17572680 0.89 CLPP (0.50) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13773558 0.89 CLPP (0.59) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14310099 0.89 CLPP (0.59) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13773710 0.89 CLPP (0.57) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14310068 0.89 CLPP (0.49) 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.

Send feedback