SCHEMBL6474565

SCHEMBL6474565

O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Nc1ccc(CCCCc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.50
KMT2A Q03164 7/20 0.50
BLM P54132 2/20 0.50
RECQL P46063 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MAPT P10636 5/20 0.44
SERPINE1 P05121 1/20 0.43
HSP90AA1 P07900 1/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
NPC1 O15118 2/20 0.41
TRPA1 O75762 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CDK2 P24941 1/20 0.41
THPO P40225 1/20 0.41
PMP22 Q01453 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL6484266 0.85 MEN1 (0.46) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6482234 0.83 KMT2A (0.60) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6474797 0.82 KMT2A (0.59) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6474951 0.82 MEN1 (0.61) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6475459 0.81 KMT2A (0.60) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6474969 0.79 KMT2A (0.66) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6526397 0.79 MEN1 (0.42) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6526395 0.79 MEN1 (0.42) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6486672 0.77 MEN1 (0.66) MEN1KMT2ABLMRECQLTDP1
SCHEMBL6482333 0.76 KMT2A (0.51) MEN1KMT2ABLMRECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6972287-B1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits PFIZER INC. (US) 2005-12-06 US claimed
US-20040220235-A1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits AUGELLI-SZAFRAN CORINNE ELIZAB (US) 2004-11-04 US claimed
EP-1225886-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-07-31 EP claimed
WO-2000076489-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 WO claimed
US-6972287-B1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits PFIZER INC. (US) 2005-12-06 US disclosed
US-20040220235-A1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits AUGELLI-SZAFRAN CORINNE ELIZAB (US) 2004-11-04 US disclosed
EP-1225886-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-07-31 EP disclosed
WO-2000076489-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 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-20040220235-A1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits APP, PSEN1, BACE1 MEN1 474/4885KMT2A 4729/4885BLM 4059/4885

“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.