SCHEMBL5111869

SCHEMBL5111869

CN(C)c1ccc(C(=O)NC2(C(=O)O)CCCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSL P07711 6/20 0.61
CTSB P07858 4/20 0.61
CTSS P25774 4/20 0.61
MAPT P10636 2/20 0.54
GFER P55789 1/20 0.54
HDAC1 Q13547 4/20 0.47
HDAC3 O15379 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
CTSK P43235 1/20 0.47
KCNK3 O14649 1/20 0.47
HDAC6 Q9UBN7 2/20 0.46
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HPGD P15428 2/20 0.43
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL5099689 0.85 CTSS (0.49) CTSLCTSBCTSSMAPTCTSK
SCHEMBL4966796 0.82 CTSK (0.50) CTSLCTSBCTSSCTSK
SCHEMBL6183362 0.81 CTSL (0.64) CTSLCTSBCTSSMAPTGFER
SCHEMBL1836676 0.81 CTSK (0.61) CTSLCTSBCTSSCTSKALDH1A1
SCHEMBL1837320 0.80 CNR2 (0.49) CTSLCTSBCTSSCTSKRAB9A
SCHEMBL1841973 0.79 CNR2 (0.52) MAPTCTSKALDH1A1POLBHPGD
SCHEMBL6183367 0.79 CTSL (0.93) CTSLCTSBCTSSCTSK
SCHEMBL1813782 0.79 CTSL (0.64) CTSLCTSBCTSSHDAC1CTSK
SCHEMBL5105059 0.78 FABP4 (0.51) CTSLCTSBCTSSMAPTCTSK
SCHEMBL1838927 0.77 GPR132 (0.50) CTSLCTSBCTSSCTSKKCNK3

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 CTSL 73/4885CTSB 71/4885CTSS 37/4885

“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.