SCHEMBL5138860

SCHEMBL5138860

CC(C)COCCC(=O)NC1(C(=O)O)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
CTSB P07858 2/20 0.35
CTSS P25774 1/20 0.35
CTSL P07711 1/20 0.34
CNR2 P34972 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
DPP4 P27487 1/20 0.32
CXCR2 P25025 1/20 0.32
SLC18A2 Q05940 1/20 0.31
LPAR1 Q92633 2/20 0.30

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
SCHEMBL13502694 0.79 CTSB (0.36) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL4764313 0.79 CNR2 (0.42) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL5112211 0.77 CNR2 (0.36) CTSBCTSSCTSLCNR2CXCR2
SCHEMBL5674430 0.76 SLC18A2 (0.42) CTSBCTSSCTSLCNR2CXCR2
SCHEMBL5110701 0.74 EPHX2 (0.49) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL5138861 0.74 CNR2 (0.33) CNR2CXCR2SLC18A2LPAR1
SCHEMBL8485391 0.72 CNR2 (0.39) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL9671904 0.72 SPHK1 (0.48) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL10594469 0.72 CTSB (0.38) CYP4F2CYP4A11CTSBCTSSCTSL
SCHEMBL19782337 0.71 MEN1 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342027-B2 1-phenylpiperidin-3-one derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2008-03-11 US disclosed
US-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof DONG-A PHARMACEUTICAL CO., LTD. (KR) 2005-10-20 US disclosed
WO-2004011457-A1 1-PHENYLPIPERIDIN-3-ONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2004-02-05 WO 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-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof CTRL, PRCP, CLPP CYP4F2 678/4885CYP4A11 612/4885CTSB 71/4885

“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.