SCHEMBL3050601

SCHEMBL3050601

O=C(C=Cc1ccc(Br)s1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
POLB P06746 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP1B1 Q16678 1/20 0.56
MAOB P27338 8/20 0.53
MAOA P21397 5/20 0.53
BCHE P06276 1/20 0.52
RAB9A P51151 2/20 0.51
KRAS P01116 1/20 0.50
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
HSPD1 P10809 1/20 0.48
HSPE1 P61604 1/20 0.48
PTPN1 P18031 1/20 0.46
LMNA P02545 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 1/20 0.46

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
SCHEMBL3050597 1.00 MAPT (0.61) MAPTPOLBKDM4EMEN1KMT2A
SCHEMBL13917708 0.83 MAPT (0.61) MAPTMEN1KMT2ACYP1B1MAOB
SCHEMBL3049844 0.80 BCHE (0.54) MAPTMEN1KMT2ACYP1B1BCHE
SCHEMBL3049846 0.80 BCHE (0.54) MAPTMEN1KMT2ACYP1B1BCHE
SCHEMBL3048659 0.76 MAPT (0.59) MAPTPOLBKDM4EMEN1KMT2A
SCHEMBL3042935 0.76 MAPT (0.43) MAPTPOLBMEN1KMT2ACYP1B1
SCHEMBL9811596 0.76 MAOB (0.59) MAPTMEN1KMT2ACYP1B1MAOB
SCHEMBL5308295 0.76 MAPT (1.00) MAPTPOLBKDM4EMEN1KMT2A
SCHEMBL3048661 0.76 MAPT (0.59) MAPTPOLBKDM4EMEN1KMT2A
SCHEMBL3042937 0.76 MAPT (0.43) MAPTPOLBMEN1KMT2ACYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100278733-A1 COMPOSITION FOR DIAGNOSIS OF AMYLOID-RELATED DISEASE NAGASAKI UNIVERSITY (JP) 2010-11-04 US disclosed
EP-2030635-A1 COMPOSITION FOR DIAGNOSING AMYLOID-RELATED DISEASE Nagasaki University (JP) 2009-03-04 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-20100278733-A1 COMPOSITION FOR DIAGNOSIS OF AMYLOID-RELATED DISEASE APP, FABP7, APBA1 MAPT 16/4885POLB 3736/4885KDM4E 4292/4885

“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.