SCHEMBL5111723

SCHEMBL5111723

CC(C)(CCl)C(=O)Nc1cc(F)ccc1N1CCC(NC(=O)C2(NC(=O)c3ccco3)CCCCC2)C(O)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
TSHR P16473 3/20 0.38
HSD17B10 Q99714 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HPGD P15428 1/20 0.38
SRPK1 Q96SB4 11/20 0.37
NTRK1 P04629 1/20 0.34
MAP4K1 Q92918 1/20 0.34
PKM P14618 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CREBBP Q92793 1/20 0.34
POLB P06746 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
SCHEMBL5104955 0.87 GPR6 (0.40) ALDH1A1MAPT
SCHEMBL5105626 0.86 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5097702 0.84 POLB (0.47) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5098243 0.83 ALDH1A1 (0.37) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5105424 0.83 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5097699 0.83 MEN1 (0.37) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5098552 0.82 ALDH1A1 (0.36) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5101585 0.82 MAPT (0.35) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5104866 0.81 ALDH1A1 (0.35) ALDH1A1TSHRHSD17B10NPSR1HPGD
SCHEMBL5097938 0.81 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10NPSR1HPGD

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 ALDH1A1 740/4885TSHR 4316/4885HSD17B10 2789/4885

“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.