SCHEMBL4177512

SCHEMBL4177512

CCCCCCCCCCN1C(=O)/C(=C(\C)O)C(=O)[C@@H]1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.48
MMP3 P08254 1/20 0.48
MMP9 P14780 1/20 0.48
KCNH2 Q12809 2/20 0.43
KMT2A Q03164 1/20 0.41
KLK7 P49862 5/20 0.41
KLK5 Q9Y337 5/20 0.41
PRSS1 P07477 2/20 0.41
PRSS2 P07478 2/20 0.41
PRSS3 P35030 2/20 0.41
FSHR P23945 3/20 0.39
KDM4E B2RXH2 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
SCHEMBL4177516 1.00 MMP1 (0.48) MMP1MMP3MMP9KCNH2KMT2A
SCHEMBL4177507 1.00 MMP1 (0.48) MMP1MMP3MMP9KCNH2KMT2A
SCHEMBL4177514 1.00 MMP1 (0.48) MMP1MMP3MMP9KCNH2KMT2A
SCHEMBL4166673 0.84 KLK7 (0.41) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4166684 0.84 KLK7 (0.41) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4166677 0.84 KLK7 (0.41) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4166683 0.84 KLK7 (0.41) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4059366 0.81 TP53 (0.42) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4159136 0.81 TP53 (0.42) MMP1MMP3MMP9KMT2AKLK7
SCHEMBL4173465 0.81 TP53 (0.42) MMP1MMP3MMP9KMT2AKLK7

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-8552208-B2 Analogs of tetramic acid University of Tennesseee Research Foundation (US) 2013-10-08 US claimed
US-8552208-B2 Analogs of tetramic acid University of Tennesseee Research Foundation (US) 2013-10-08 US disclosed
US-20090069406-A1 Analogs of tetramic acid NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-03-12 US 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-20090069406-A1 Analogs of tetramic acid TFRC, SLC7A1, FTH1 MMP1 2172/4885MMP3 3351/4885MMP9 2455/4885

“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.