SCHEMBL4036561

SCHEMBL4036561

NC(=O)N1CCN(S(=O)(=O)c2ccccc2)C(Cc2cccc3ccccc23)(C(N)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.38
F13A1 P00488 1/20 0.37
TGM2 P21980 1/20 0.37
TGM1 P22735 1/20 0.37
KMT2A Q03164 2/20 0.36
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36
OPRK1 P41145 3/20 0.35
NPFFR1 Q9GZQ6 3/20 0.35
NPFFR2 Q9Y5X5 3/20 0.35
OPRD1 P41143 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
OPRM1 P35372 2/20 0.35
MEN1 O00255 1/20 0.35
TPSAB1 Q15661 1/20 0.34
MTNR1A P48039 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CA2 P00918 1/20 0.34
SLC1A3 P43003 1/20 0.33

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
SCHEMBL4036536 0.72 MAPT (0.45) KMT2AMEN1MAPTNPSR1
SCHEMBL5737569 0.70 OPRK1 (0.40) KMT2AOPRK1NPFFR1NPFFR2OPRD1
SCHEMBL5635019 0.68 MAPT (0.39) KMT2AMAPTNPSR1CA2
SCHEMBL4041098 0.66 FABP1 (0.45) MAPT
SCHEMBL4034457 0.63 GAA (0.39) KMT2AMEN1MAPTNPSR1CA2
SCHEMBL851280 0.60 TAOK1 (0.48) KMT2AGRM2GRM3TDP1MEN1
SCHEMBL16673587 0.60 FAAH (0.71) FAAHKMT2AMEN1MAPT
SCHEMBL31208422 0.59 TDP1 (0.62) KMT2ATDP1MEN1MAPTCA2
SCHEMBL30735738 0.59 USP2 (0.55)
SCHEMBL31208426 0.59 TDP1 (0.62) KMT2ATDP1MEN1MAPTCA2

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 FAAH 151/4885F13A1 383/4885TGM2 3512/4885

“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.