SCHEMBL5635564

SCHEMBL5635564

CCN(CC)CCNC(=O)C1CN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 10/20 0.51
MMP9 P14780 9/20 0.51
MMP13 P45452 9/20 0.51
MMP3 P08254 8/20 0.50
MMP7 P09237 7/20 0.50
GAA P10253 1/20 0.47
MCHR1 Q99705 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL5634849 0.92 MMP1 (0.52) MMP1MMP9MMP13MMP3MMP7
SCHEMBL5635339 0.91 MMP1 (0.50) MMP1MMP9MMP13MMP3MMP7
SCHEMBL5634717 0.87 GAA (0.46) MMP1MMP9MMP13MMP3MMP7
SCHEMBL4032820 0.85 GAA (0.49) MMP1MMP9MMP13MMP3MMP7
SCHEMBL4033302 0.84 MMP1 (0.48) MMP1MMP9MMP13MMP3MMP7
SCHEMBL4035027 0.83 L3MBTL1 (0.47) MMP1MMP9MMP13MMP3MMP7
SCHEMBL4038558 0.83 MMP1 (0.51) MMP1MMP9MMP13MMP3MMP7
SCHEMBL5634226 0.82 MCHR1 (0.55) MMP1MMP9MMP13MMP3MMP7
SCHEMBL5635556 0.80 MMP1 (0.53) MMP1MMP9MMP13MMP3MMP7
SCHEMBL4035430 0.79 MMP1 (0.47) MMP1MMP9MMP13MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US claimed
US-8404690-B2 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2013-03-26 US disclosed
US-8404690-B2 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2013-03-26 US disclosed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US disclosed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US disclosed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 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-20070142391-A1 Piperazine-2-carboxamide derivatives P2RX5, P2RX2, NPY5R MMP1 3474/4885MMP9 4189/4885MMP13 2519/4885

“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.