SCHEMBL14749138

SCHEMBL14749138

CC(C)C(C)C(=O)N1CCN(c2ncccn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.54
▸ KDM4E B2RXH2 5/20 0.51
▸ PKM P14618 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ LIPE Q05469 1/20 0.49
▸ SLC6A7 Q99884 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ GAA P10253 1/20 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
SCHEMBL1911514 0.87 LMNA (0.56) LMNAKDM4EPKMMAPK1HSD17B10
SCHEMBL5888121 0.80 HSD17B10 (0.56) LMNAKDM4EPKMMAPK1HSD17B10
SCHEMBL10861692 0.79 MEN1 (0.50) LMNAKDM4EPKMMAPK1HSD17B10
SCHEMBL10861683 0.79 MEN1 (0.50) LMNAKDM4EPKMMAPK1HSD17B10
SCHEMBL1919434 0.78 MEN1 (0.73) KDM4EPKMHSD17B10SLC6A7CYP1A2
SCHEMBL27580589 0.77 KDM4E (0.62) KDM4EPKMHSD17B10SLC6A7CYP1A2
SCHEMBL389894 0.76 KDM4E (0.56) LMNAKDM4EKMT2AMEN1ALDH1A1
SCHEMBL13149261 0.76 HSD17B10 (0.65) LMNAKDM4EMAPK1HSD17B10SLC6A7
SCHEMBL2856220 0.75 GAA (0.61) LMNAKDM4EHSD17B10SLC6A7CYP2C19
SCHEMBL9558198 0.74 MEN1 (0.59) LMNAKDM4EPKMMAPK1HSD17B10

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-20130059803-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2013-03-07 — — 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-20130059803-A1 BORON-CONTAINING SMALL MOLECULES ETF1, POLR1C, DPM1 LMNA 3138/4885KDM4E 3418/4885PKM 4663/4885

“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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