SCHEMBL4041098

SCHEMBL4041098

NC(=O)N1CCN(S(=O)(=O)c2cccc3cccnc23)C(Cc2ccc(F)cc2)(C(N)=O)C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FABP1 P07148 2/20 0.45
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.43
PKLR P30613 4/20 0.42
HSD11B1 P28845 1/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4032961 0.83 PKM (0.49) MAPTMAPK1PKLRHSD11B1L3MBTL1
SCHEMBL4037678 0.79 GAA (0.46) FABP1MAPTMAPK1PKLRHSD11B1
SCHEMBL4038904 0.77 QPCT (0.49) MAPTPKLRHSD11B1L3MBTL1
Trifluoroacetic Acid SCHEMBL4033431 0.75 QPCT (0.45) MAPTPKLR
SCHEMBL4037687 0.74 GAA (0.45) FABP1MAPTMAPK1PKLRL3MBTL1
SCHEMBL4035617 0.70 ALDH1A1 (0.46) MAPTMAPK1
SCHEMBL1382339 0.69 MAPK1 (0.49) FABP1MAPTMAPK1
SCHEMBL1382337 0.68 FABP1 (0.45) FABP1MAPTMAPK1HTR2AHTR2C
SCHEMBL7027668 0.66 FABP1 (0.65) FABP1MAPTMAPK1HTR2AHTR2C
SCHEMBL4036561 0.66 FAAH (0.38) MAPT

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 FABP1 4463/4885MAPT 4555/4885MAPK1 3742/4885

“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.