SCHEMBL3273795

SCHEMBL3273795

O=C(C=Cc1cccc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.70
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
RAB9A P51151 2/20 0.65
ALDH1A1 P00352 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
NPC1 O15118 1/20 0.56
HTT P42858 1/20 0.56
LMNA P02545 2/20 0.55
MAPT P10636 2/20 0.55
MAPK1 P28482 1/20 0.55
RECQL P46063 1/20 0.55

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
SCHEMBL3273786 1.00 TRPV1 (0.70) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL8065895 0.87 TRPV1 (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL8065896 0.87 TRPV1 (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL8065998 0.84 TRPV1 (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL8065999 0.84 TRPV1 (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL15176833 0.82 TRPV1 (1.00) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL10734737 0.79 MMP1 (0.72) MAPT
SCHEMBL10734728 0.79 MMP1 (0.72) MAPT
SCHEMBL5779943 0.79 RAB9A (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1
SCHEMBL5778272 0.79 RAB9A (0.67) TRPV1MEN1KMT2ARAB9AALDH1A1

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
US-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 US claimed
US-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 US disclosed
EP-2121569-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-11-25 EP disclosed
WO-2008074755-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-06-26 WO 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-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS TRPV1, TRPA1, TRPM8 TRPV1 1/4885MEN1 3888/4885KMT2A 2108/4885

“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.