SCHEMBL6079109

SCHEMBL6079109

COC(=O)N1CCC(C)C(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.38
BRDT Q58F21 1/20 0.38
TSHR P16473 1/20 0.37
CHRNB2 P17787 2/20 0.37
CHRNA4 P43681 2/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
EPHX1 P07099 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP2D6 P10635 1/20 0.34
KMT2A Q03164 1/20 0.34
PDE4B Q07343 3/20 0.34
PDE4A P27815 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CYP4F2 P78329 1/20 0.33

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
Formaldehyde SCHEMBL6083170 0.97 BRD4 (0.36) BRD4BRDTTSHRCHRNB2CHRNA4
SCHEMBL10460267 0.83 GAA (0.50) BRD4TSHRL3MBTL1GAAALDH1A1
SCHEMBL19420091 0.81 MAPT (0.48) EPHX1L3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL19420078 0.81 MAPT (0.48) EPHX1L3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL5765921 0.81 MAPT (0.48) EPHX1L3MBTL1MAPTALDH1A1SMN1; SMN2
Ethylene SCHEMBL10458550 0.80 GAA (0.47) BRD4TSHRL3MBTL1GAAALDH1A1
SCHEMBL3621172 0.79 BRD4 (0.38) BRD4BRDTTSHRCHRNB2CHRNA4
SCHEMBL3621568 0.73 GAA (0.43) TSHRL3MBTL1GAAMAPTALDH1A1
SCHEMBL771850 0.72 GAA (0.53) BRD4BRDTTSHRCHRNB2CHRNA4
SCHEMBL17787817 0.72 GAA (0.34) BRD4BRDTTSHREPHX1L3MBTL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014083150-A1 PREPARATION OF 3-AMINO-PIPERIDINE COMPOUNDS VIA NITRO-TETRAHYDROPYRIDINE PRECURSORS LEK PHARMACEUTICALS D.D. (SI) 2014-06-05 WO disclosed
CN-103755624-A Synthetic method of piperidine derivative LANZHOU BOC CHEMICAL CO LTD 2014-04-30 CN disclosed
US-7084277-B2 Reacting 1-alkoxycarbonyl-3-oxo piperidine compound with an amine; reducing with reducing agent PFIZER INC. (US) 2006-08-01 US disclosed
EP-1572649-A2 3-AMINO-PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION Pfizer Products Inc. (US) 2005-09-14 EP disclosed
WO-2004046112-A2 3-AMINO-PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION PFIZER PRODUCTS INC. (US) 2004-06-03 WO disclosed
US-20040102627-A1 3-Amino-piperadine derivatives and methods of manufacture PFIZER INC. 2004-05-27 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-20040102627-A1 3-Amino-piperadine derivatives and methods of manufacture PRMT5, SRM, CYP1B1 BRD4 568/4885BRDT 3936/4885TSHR 3290/4885

“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.