SCHEMBL6754378

SCHEMBL6754378

O=C(C=Cc1ccccc1)Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.73
KMT2A Q03164 6/20 0.70
MEN1 O00255 5/20 0.70
ALDH1A1 P00352 4/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
MAPT P10636 4/20 0.67
RAB9A P51151 2/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2C19 P33261 1/20 0.67
HSP90AA1 P07900 1/20 0.64
HPGD P15428 1/20 0.64
MAPK1 P28482 1/20 0.64
CACNA1B Q00975 1/20 0.64
APBA1 Q02410 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
NLRP1 Q9C000 1/20 0.64
MMP1 P03956 4/20 0.64
MMP2 P08253 4/20 0.64
MMP9 P14780 4/20 0.64

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
SCHEMBL6754380 1.00 TRPV1 (0.73) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL23547197 1.00 TRPV1 (0.73) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL6860426 0.88 TRPV1 (0.76) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL6860429 0.88 TRPV1 (0.76) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL5448327 0.88 HPGD (0.79) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL5448329 0.88 HPGD (0.79) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL8065947 0.86 MEN1 (0.84) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL8065945 0.86 MEN1 (0.84) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13675641 0.85 KMT2A (0.67) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL10823954 0.85 ALDH1A1 (0.63) TRPV1KMT2AMEN1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115650986-B Cinnamoyl amino pyrazolo [3,4-d ] pyrimidine compound, and preparation and application thereof 浙江工业大学 2024-07-30 CN disclosed
CN-115286589-B Cinnamoyl tetrazine compound, and preparation and application thereof 浙江工业大学 2024-04-09 CN disclosed
CN-115650986-A Cinnamyl amino pyrazolo [3,4-d ] pyrimidine compound and preparation and application thereof 浙江工业大学 2023-01-31 CN disclosed
CN-115286589-A Cinnamoyl tetrazine compound and preparation and application thereof 浙江工业大学 2022-11-04 CN disclosed
US-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 TRPV1 1618/4885KMT2A 130/4885MEN1 970/4885

“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.