SCHEMBL14066497

SCHEMBL14066497

CC(C)C[C@H](CN(O)C=O)C(=O)N[C@H](C(=O)N1CCC(NC(=O)c2ccc(C(F)(F)F)cc2)CC1)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
EPHX2 P34913 6/20 0.42
SLC6A5 Q9Y345 7/20 0.41
TEAD1 P28347 1/20 0.40
PHGDH O43175 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DRD4 P21917 1/20 0.38
HDAC4 P56524 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL4886058 0.93 KMT2A (0.43) TSHRMEN1KMT2ANPSR1
SCHEMBL4886049 0.93 KMT2A (0.43) TSHRMEN1KMT2ANPSR1
SCHEMBL4602951 0.91 NPSR1 (0.48) TSHRMEN1KMT2ANPSR1
SCHEMBL4877576 0.91 NPSR1 (0.48) TSHRMEN1KMT2ANPSR1
SCHEMBL4603077 0.90 TSHR (0.41) TSHREPHX2SLC6A5TEAD1PHGDH
SCHEMBL4883080 0.90 TSHR (0.41) TSHREPHX2SLC6A5TEAD1PHGDH
SCHEMBL4887977 0.89 TSHR (0.41) TSHREPHX2MEN1KMT2ANPSR1
SCHEMBL4887987 0.89 TSHR (0.41) TSHREPHX2MEN1KMT2ANPSR1
SCHEMBL4884726 0.86 PDF (0.45) TSHREPHX2SLC6A5TEAD1PHGDH
SCHEMBL4884713 0.86 PDF (0.45) TSHREPHX2SLC6A5TEAD1PHGDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234333-A1 Novel Hydroxamic Acid Derivative as Peptide Deformylase Inhibitor and Manufacturing Method Thereof KANG JAE-HOON 2008-09-25 US disclosed
WO-2006115353-A9 A NOVEL HYDROXAMIC ACID DERIVATIVE AS PEPTIDE DEFORMYLASE INHIBITOR AND MANUFACTURING METHOD THEREOF ILDONG PHARMACEUTICAL CO LTD (KR) 2007-03-22 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-20080234333-A1 Novel Hydroxamic Acid Derivative as Peptide Deformylase Inhibitor and Manufacturing Method Thereof PDF, PEPD, DHPS TSHR 3586/4885EPHX2 2553/4885SLC6A5 2392/4885

“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.