SCHEMBL6503584

SCHEMBL6503584

COC(=O)c1ccc(C)c(-n2c(C)cc(CBr)cc2=O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
OPRK1 P41145 1/20 0.43
LMNA P02545 2/20 0.40
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
POLB P06746 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MITF O75030 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 2/20 0.38
GAA P10253 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPK14 Q16539 2/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL6471875 0.89 ALDH1A1 (0.56) ALDH1A1OPRK1LMNAPDE4APDE4B
SCHEMBL2706645 0.82 ALDH1A1 (0.60) ALDH1A1OPRK1LMNAPDE4APDE4B
SCHEMBL6471091 0.81 ALDH1A1 (0.58) ALDH1A1OPRK1LMNAPOLBGAA
SCHEMBL6506511 0.78 MAPK14 (0.51) ALDH1A1OPRK1LMNAMAPTRAB9A
SCHEMBL2707694 0.74 ALDH1A1 (0.56) ALDH1A1OPRK1LMNAPDE4APDE4B
SCHEMBL14989717 0.72 ALDH1A1 (0.51) ALDH1A1OPRK1LMNAPDE4APDE4B
SCHEMBL4509497 0.72 ALDH1A1 (0.57) ALDH1A1OPRK1LMNAPDE4APDE4B
SCHEMBL4383585 0.72 MAPT (0.46) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL4387429 0.72 ALDH1A1 (0.47) ALDH1A1LMNAMEN1KMT2AMITF
SCHEMBL13603337 0.72 MAPK14 (0.47) ALDH1A1MAPK14ROCK2MAPK12MAPK11

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 ALDH1A1 741/4885OPRK1 282/4885LMNA 1884/4885

“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.