SCHEMBL5098156

SCHEMBL5098156

Nc1cc(F)ccc1N1CCC(NC(=O)C2(NC(=O)c3ccc(F)cc3)CCCCC2)C(O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
HTT P42858 2/20 0.39
CTSS P25774 6/20 0.39
CTSL P07711 5/20 0.39
CTSK P43235 3/20 0.39
TSHR P16473 1/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
CTSB P07858 4/20 0.36
TRPA1 O75762 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ACKR3 P25106 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HPGD P15428 2/20 0.35
HDAC1 Q13547 1/20 0.34
MAPT P10636 1/20 0.34
CCR3 P51677 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
Hydrochloric Acid SCHEMBL5111568 0.81 CTSK (0.44) KDM4EHTTCTSSCTSLCTSK
SCHEMBL5111742 0.78 HDAC2 (0.42) KDM4EHTTALDH1A1NPC1RAB9A
SCHEMBL5098552 0.76 ALDH1A1 (0.36) TSHRALDH1A1NPC1RAB9AACKR3
SCHEMBL5101585 0.76 MAPT (0.35) TSHRALDH1A1ACKR3NPSR1HPGD
SCHEMBL5101583 0.76 ALDH1A1 (0.34) TSHRALDH1A1NPC1RAB9AACKR3
SCHEMBL5105424 0.75 ALDH1A1 (0.38) KDM4ETSHRALDH1A1ACKR3NPSR1
SCHEMBL5101562 0.75 TACR2 (0.40) KDM4EHTTALDH1A1NPC1RAB9A
SCHEMBL5110959 0.75 TACR2 (0.39) KDM4EHTTALDH1A1NPC1RAB9A
SCHEMBL5110965 0.75 TACR2 (0.41) KDM4EHTTALDH1A1NPC1RAB9A
SCHEMBL5105055 0.75 NPSR1 (0.44) KDM4EHTTTSHRALDH1A1NPC1

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 KDM4E 2744/4885HTT 1063/4885CTSS 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.