SCHEMBL6499889

SCHEMBL6499889

COC(=O)c1cccc(-n2c(COC(C)=O)cc(O)c(Br)c2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 4/20 0.42
PMM2 O15305 1/20 0.41
MPI P34949 1/20 0.41
RAB9A P51151 1/20 0.41
PHOSPHO1 Q8TCT1 1/20 0.41
ALOX15 P16050 1/20 0.40
GAA P10253 1/20 0.40
TDP2 O95551 1/20 0.40
EGFR P00533 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL6508658 0.84 ALDH1A1 (0.45) TP53MAPTALDH1A1PMM2MPI
SCHEMBL4387425 0.82 ALDH1A1 (0.43) TP53MAPTALDH1A1RAB9AALOX15
SCHEMBL6471276 0.79 MAPK14 (0.64) MAPK14
SCHEMBL4390681 0.73 PARP1 (0.43) MAPTALDH1A1ALOX15GAAKDM4E
SCHEMBL4379826 0.69 ALDH1A1 (0.60) TP53MAPTALDH1A1PMM2MPI
SCHEMBL4387249 0.69 ALDH1A1 (0.47) TP53MAPTALDH1A1RAB9AALOX15
SCHEMBL6472051 0.69 MAPK14 (0.76) MAPK14
SCHEMBL4384468 0.68 ALDH1A1 (0.52) TP53MAPTALDH1A1ALOX15GAA
SCHEMBL6504567 0.67 ALDH1A1 (0.50) TP53MAPTALDH1A1ALOX15KDM4E
SCHEMBL7826732 0.66 ALDH1A1 (0.57) TP53MAPTALDH1A1PMM2MPI

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-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US 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-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 TP53 1598/4885MAPT 2543/4885ALDH1A1 741/4885

“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.