SCHEMBL4474931

SCHEMBL4474931

COc1ccc(Cn2ccc(Oc3ccccc3)cc2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.57
MAPT P10636 3/20 0.54
TP53 P04637 2/20 0.54
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LTA4H P09960 1/20 0.49
FAAH O00519 1/20 0.47
MGLL Q99685 1/20 0.47
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
CMA1 P23946 1/20 0.45
RHEB Q15382 1/20 0.45
CHRM1 P11229 1/20 0.44
NPBWR1 P48145 1/20 0.44

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
SCHEMBL4481396 0.89 MAPK14 (0.70) MAPK14MEN1KMT2ARHEB
SCHEMBL17392844 0.86 MAPK14 (0.70) MAPK14MAPTTP53LMNAKDM4E
SCHEMBL2178268 0.84 MAPK14 (0.82) MAPK14MAPTTP53LMNA
SCHEMBL4295434 0.79 MAPT (0.62) MAPK14MAPTTP53LMNACMA1
SCHEMBL3520613 0.78 CYP11B2 (0.50) MAPTTP53LMNAKDM4EFAAH
SCHEMBL17963973 0.77 MAPT (0.52) MAPK14MAPTTP53LMNAKDM4E
SCHEMBL32665079 0.77 MAPT (0.52) MAPK14MAPTTP53LMNAKDM4E
SCHEMBL29348749 0.77 MAPK14 (0.51) MAPK14MAPTTP53LMNACMA1
SCHEMBL4476017 0.75 MAPK14 (0.57) MAPK14MAPTTP53LMNAKDM4E
SCHEMBL17993127 0.75 MAPT (0.45) MAPK14MAPTTP53LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US claimed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 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 (2 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-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAPK14 41/4885MAPT 2803/4885TP53 1849/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885MAPT 2543/4885TP53 1598/4885

“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.