SCHEMBL5659601

SCHEMBL5659601

CS(=O)(=O)OC(Cc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 6/20 0.41
HTT P42858 1/20 0.39
KMT2A Q03164 2/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL6105425 0.82 BCHE (0.46) HTTALDH1A1
SCHEMBL490895 0.81 CPA1 (0.45) CPA1ALDH1A1
SCHEMBL5594547 0.80 CPA1 (0.47) CPA1ALDH1A1
SCHEMBL7987728 0.78 TAAR1 (0.43) KMT2AMEN1
SCHEMBL3593147 0.77 MEN1 (0.43) KMT2AMMP1MMP9MMP13MEN1
SCHEMBL22441312 0.77 TAAR1 (0.47) KMT2AMEN1
SCHEMBL21378558 0.77 TAAR1 (0.47) KMT2AMEN1
SCHEMBL3589541 0.77 TAAR1 (0.47) KMT2AMEN1
SCHEMBL7054871 0.75 CPA1 (0.42) CPA1KMT2AMEN1ALDH1A1
SCHEMBL7054868 0.75 CPA1 (0.42) CPA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166617-B2 Cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-01-23 US disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 EP 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-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 CPA1 3659/4885HTT 4761/4885KMT2A 2651/4885

“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.