SCHEMBL6792707

SCHEMBL6792707

CCN(CC)c1ccc(C=C2N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 4/20 0.48
MAPT P10636 4/20 0.48
KMT2A Q03164 4/20 0.48
DAPK3 O43293 6/20 0.47
KDM4E B2RXH2 3/20 0.44
POLB P06746 1/20 0.44
NOTUM Q6P988 1/20 0.44
PLCG2 P16885 2/20 0.43
ALOX5 P09917 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
PKM P14618 1/20 0.42
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
TLR9 Q9NR96 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
SCHEMBL6792703 1.00 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6789678 0.92 DAPK3 (0.48) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6789684 0.92 DAPK3 (0.48) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL15347299 0.89 MEN1 (0.50) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6794063 0.89 MEN1 (0.50) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6794067 0.89 MEN1 (0.50) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6794802 0.85 ALDH1A1 (0.59) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6794799 0.85 ALDH1A1 (0.59) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6795940 0.83 DAPK3 (0.64) ALDH1A1MEN1MAPTKMT2ADAPK3
SCHEMBL6795935 0.83 DAPK3 (0.64) ALDH1A1MEN1MAPTKMT2ADAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040180943-A1 Oxazolone analogs as amyloid aggregation inhibitors and for the treatment of alzheimer's disease and disorders related to amyloidosis WARNER-LAMBERT COMPANY LLC 2004-09-16 US claimed

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-20040180943-A1 Oxazolone analogs as amyloid aggregation inhibitors and for the treatment of alzheimer's disease and disorders related to amyloidosis APP, PSEN1, PSEN2 ALDH1A1 905/4885MEN1 2646/4885MAPT 6/4885

“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.