SCHEMBL14504287

SCHEMBL14504287

CC1C(=O)N(Cc2ccccc2)C[C@H]2N1C(=O)CN2N(C)C(=O)NCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CACNA1G O43497 14/20 0.44
▸ CACNA1I Q9P0X4 14/20 0.44
▸ CACNA1H O95180 13/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ SIRT5 Q9NXA8 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CLPP Q16740 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38

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
SCHEMBL14309433 0.89 CACNA1G (0.41) CACNA1GCACNA1ICACNA1HKMT2AMEN1
SCHEMBL14309426 0.89 CLPP (0.51) CLPPCYP3A4
SCHEMBL14319440 0.85 CLPP (0.47) CLPPCYP3A4
SCHEMBL14309878 0.85 CTNNB1 (0.54) CLPPCYP3A4
SCHEMBL13773538 0.85 KMT2A (0.39) CACNA1GCACNA1ICACNA1HKMT2AMEN1
SCHEMBL14309463 0.84 KMT2A (0.41) CACNA1GCACNA1ICACNA1HKMT2AMEN1
SCHEMBL14308269 0.84 CLPP (0.47) CACNA1ICLPPCYP3A4
SCHEMBL14309451 0.84 CLPP (0.47) KMT2AMEN1CLPPCYP3A4
SCHEMBL14310175 0.84 CACNA1I (0.42) CACNA1GCACNA1ICACNA1HKMT2AMEN1
SCHEMBL14310108 0.82 HDAC1 (0.39) CACNA1GCACNA1ICACNA1HKMT2AMEN1

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 CACNA1G 4680/4885CACNA1I 4831/4885CACNA1H 4289/4885

“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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