SCHEMBL4036409

SCHEMBL4036409

CCN1CCCC1CNC(=O)C1CN(S(=O)(=O)c2ccc(CNC(=O)c3ccc(Cl)cc3)s2)CCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK9 P45984 1/20 0.45
MAPK10 P53779 1/20 0.45
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MCHR1 Q99705 1/20 0.41
USP2 O75604 1/20 0.40
POLB P06746 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
SCHEMBL4032630 0.80 ALDH1A1 (0.56) ALDH1A1GAAUSP2
SCHEMBL4033428 0.74 MMP1 (0.59) ALDH1A1MCHR1
SCHEMBL5634718 0.73 HCRTR1 (0.47) ALDH1A1L3MBTL1
SCHEMBL8163274 0.71 MCHR1 (0.67) KMT2AALDH1A1GAAL3MBTL1MCHR1
SCHEMBL13952063 0.71 MCHR1 (0.67) KMT2AALDH1A1GAAL3MBTL1MCHR1
SCHEMBL5634226 0.70 MCHR1 (0.55) KMT2AALDH1A1L3MBTL1MCHR1
SCHEMBL7701724 0.70 MAPK9 (0.62) MEN1KMT2AMAPK9MAPK10ALDH1A1
SCHEMBL2424858 0.69 MAPK9 (0.61) MEN1KMT2AMAPK9MAPK10ALDH1A1
SCHEMBL4032723 0.69 MMP1 (0.61) ALDH1A1L3MBTL1MCHR1
SCHEMBL3480210 0.69 MAPK9 (0.49) MEN1KMT2AMAPK9MAPK10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP claimed
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
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP 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 MEN1 4821/4885KMT2A 396/4885MAPK9 4406/4885

“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.