SCHEMBL6802756

SCHEMBL6802756

O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=NC1=Cc1ccncc1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DAPK3 O43293 11/20 0.79
ALOX5 P09917 2/20 0.61
GAA P10253 1/20 0.48
MAPT P10636 2/20 0.47
NOTUM Q6P988 1/20 0.47
MAPK1 P28482 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
PLCG2 P16885 1/20 0.46
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL6802752 1.00 DAPK3 (0.79) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL6795284 0.88 DAPK3 (0.71) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL6795280 0.88 DAPK3 (0.71) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL6795935 0.83 DAPK3 (0.64) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL6795940 0.83 DAPK3 (0.64) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL29517925 0.83 PLCG2 (0.69) DAPK3ALOX5MAPTNOTUMMAPK1
SCHEMBL6796902 0.81 DAPK3 (0.58) DAPK3ALOX5MAPTNOTUMMEN1
SCHEMBL6796899 0.81 DAPK3 (0.58) DAPK3ALOX5MAPTNOTUMMEN1
SCHEMBL6801419 0.75 DAPK3 (0.64) DAPK3ALOX5GAAMAPTNOTUM
SCHEMBL6801416 0.75 DAPK3 (0.64) DAPK3ALOX5GAAMAPTNOTUM

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 DAPK3 1049/4885ALOX5 1156/4885GAA 74/4885

“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.