SCHEMBL4989464

SCHEMBL4989464

CC(=O)c1cc(Br)ccc1OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
POLB P06746 2/20 0.51
MEN1 O00255 2/20 0.51
KRAS P01116 1/20 0.46
MMP1 P03956 1/20 0.45
PTGS2 P35354 2/20 0.45
CYP19A1 P11511 1/20 0.45
MAOB P27338 3/20 0.44
MAOA P21397 2/20 0.44
MAPT P10636 2/20 0.43
HSP90AA1 P07900 1/20 0.43
CCR6 P51684 1/20 0.43
PTGS1 P23219 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
BCHE P06276 1/20 0.42

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
SCHEMBL4989475 1.00 KMT2A (0.51) KMT2APOLBMEN1KRASMMP1
SCHEMBL10144975 0.87 MMP1 (0.47) KMT2AMEN1KRASMMP1PTGS2
SCHEMBL4982840 0.86 MAPT (0.57) KMT2AMEN1KRASMMP1PTGS2
SCHEMBL4982850 0.86 MAPT (0.57) KMT2AMEN1KRASMMP1PTGS2
SCHEMBL4985532 0.79 MAPT (0.54) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL15367534 0.75 MAOB (0.61) KMT2APOLBMEN1PTGS2MAOB
SCHEMBL17355377 0.75 MAOB (0.61) KMT2APOLBMEN1PTGS2MAOB
SCHEMBL5315888 0.75 MAOB (0.61) KMT2APOLBMEN1PTGS2MAOB
SCHEMBL9523424 0.75 MAOB (0.61) KMT2APOLBMEN1PTGS2MAOB
SCHEMBL522693 0.72 CA12 (0.62) KMT2AMEN1KRASPTGS2MAOB

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-8192717-B2 Flavone derivative, chalcone derivative, styrylchromone derivative, or a coumarin derivative with high binding specificity to an amyloid beta protein, high permeability to a blood-brain barrier, and ability to rapidly disappear from sites other than cerebral senile plaque; also drug screening NAGASAKI UNIVERSITY (JP) 2012-06-05 US disclosed
US-20080131367-A1 Composition For Diagnosing Amyloid-Related Diseases Mori, Hiroshi (JP) 2008-06-05 US disclosed
EP-1815872-A1 COMPOSITION FOR AMYLOID-ASSOCIATED DISEASE DIAGNOSIS Nagasaki University (JP) 2007-08-08 EP disclosed
EP-1815872-A1 COMPOSITION FOR AMYLOID-ASSOCIATED DISEASE DIAGNOSIS Nagasaki University (JP) 2007-08-08 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-20080131367-A1 Composition For Diagnosing Amyloid-Related Diseases APP, APBA1, FABP7 KMT2A 4676/4885POLB 4169/4885MEN1 2273/4885

“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.