SCHEMBL5635689

SCHEMBL5635689

NC(=O)C1CNCCN1S(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 5/20 0.52
MMP1 P03956 4/20 0.52
MMP13 P45452 4/20 0.52
MMP3 P08254 1/20 0.52
MMP7 P09237 1/20 0.52
ALDH1A1 P00352 2/20 0.48
ADAM17 P78536 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GHSR Q92847 1/20 0.44
MMP2 P08253 1/20 0.42
TSHR P16473 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL7369631 0.89 MMP1 (0.56) MMP9MMP1MMP13MMP3MMP7
SCHEMBL1617124 0.85 PKM (0.55) MMP9MMP1MMP13MMP3MMP7
SCHEMBL3914496 0.80 MMP1 (0.58) MMP9MMP1MMP13MMP3MMP7
SCHEMBL17833176 0.80 MMP2 (0.59) MMP9ALDH1A1GHSRMMP2CYP3A4
SCHEMBL695071 0.80 MMP2 (0.59) MMP9ALDH1A1GHSRMMP2CYP3A4
SCHEMBL5634637 0.79 PKM (0.46) MMP9MMP1MMP13MMP3MMP7
SCHEMBL8718942 0.78 LMNA (0.58) MMP9ALDH1A1GHSRMMP2CYP3A4
SCHEMBL7765009 0.78 MMP1 (0.58) MMP9MMP1MMP13MMP3MMP7
SCHEMBL15094517 0.77 MMP1 (0.47) MMP9MMP1MMP13MMP3MMP7
SCHEMBL27583610 0.77 MMP1 (0.54) MMP9MMP1MMP13MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4518853-A1 OREXIN RECEPTOR AGONISTS Merck Sharp & Dohme LLC (US) 2025-03-12 EP disclosed
WO-2023215205-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2023-11-09 WO 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

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 MMP9 4189/4885MMP1 3474/4885MMP13 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.