SCHEMBL4887577

SCHEMBL4887577

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@H](C(=O)N1CCC(NC(=O)c2ccc(Br)cc2)CC1)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 0.51
MMP3 P08254 10/20 0.51
MMP9 P14780 9/20 0.51
MMP1 P03956 7/20 0.51
MMP8 P22894 6/20 0.51
MMP14 P50281 3/20 0.51
MMP13 P45452 1/20 0.51
ADAM17 P78536 1/20 0.51
TSHR P16473 1/20 0.42
MMP7 P09237 1/20 0.42
BMP1 P13497 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL4880753 0.92 MMP2 (0.50) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4617307 0.92 MMP2 (0.50) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4877176 0.92 MMP2 (0.53) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4887742 0.91 MMP2 (0.49) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4618893 0.90 MMP2 (0.48) MMP2MMP3MMP9MMP1MMP8
SCHEMBL14066489 0.89 MMP3 (0.51) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4616327 0.89 MMP3 (0.51) MMP2MMP3MMP9MMP1MMP8
SCHEMBL4614445 0.88 MMP2 (0.49) MMP2MMP3MMP1MMP13BMP1
SCHEMBL4880474 0.88 MMP2 (0.49) MMP2MMP3MMP1MMP13BMP1
SCHEMBL4884035 0.84 MMP2 (0.56) MMP2MMP3MMP9MMP1MMP8

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 4 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
US-20080234333-A1 Novel Hydroxamic Acid Derivative as Peptide Deformylase Inhibitor and Manufacturing Method Thereof KANG JAE-HOON 2008-09-25 US disclosed
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 MMP2 315/4885MMP3 362/4885MMP9 639/4885

“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.