SCHEMBL5099689

SCHEMBL5099689

CCN(CC)c1ccc(C(=O)NC2(C(=O)O)CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.49
CTSL P07711 5/20 0.49
CTSB P07858 5/20 0.49
CTSK P43235 3/20 0.47
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
CNR2 P34972 1/20 0.45
ESRRG P62508 3/20 0.43
POLB P06746 2/20 0.43
GAA P10253 2/20 0.43
LMNA P02545 1/20 0.43
ESRRB O95718 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MCL1 Q07820 1/20 0.43
NOX1 Q9Y5S8 1/20 0.43

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
SCHEMBL5111869 0.85 CTSL (0.61) CTSSCTSLCTSBCTSKMAPT
SCHEMBL4966796 0.78 CTSK (0.50) CTSSCTSLCTSBCTSK
SCHEMBL1836676 0.78 CTSK (0.61) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL1837320 0.77 CNR2 (0.49) CTSSCTSLCTSBCTSKKDM4E
SCHEMBL1976504 0.77 PLK1 (0.55) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL1840229 0.76 CTSK (0.50) CTSSCTSLCTSBCTSKCNR2
SCHEMBL1841973 0.76 CNR2 (0.52) CTSKMAPTALDH1A1KDM4EHTT
SCHEMBL1813782 0.76 CTSL (0.64) CTSSCTSLCTSBCTSKMEN1
SCHEMBL5105059 0.74 FABP4 (0.51) CTSSCTSLCTSBCTSKMAPT
SCHEMBL1838927 0.74 GPR132 (0.50) CTSSCTSLCTSBCTSKALDH1A1

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 CTSS 37/4885CTSL 73/4885CTSB 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.