SCHEMBL6234858

SCHEMBL6234858

COc1ccc(-c2nc(C(O)CC(C)C)oc2-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 2/20 0.44
PPARD Q03181 6/20 0.43
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
MAPK1 P28482 1/20 0.41
NOD2 Q9HC29 1/20 0.41
PPARA Q07869 3/20 0.41
ANO1 Q5XXA6 2/20 0.39
GSK3B P49841 1/20 0.39
NPC1 O15118 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 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
SCHEMBL6206651 0.88 NPSR1 (0.47) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6538937 0.87 NPSR1 (0.51) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6539116 0.86 ESR2 (0.43) LMNAALDH1A1MAPTPPARDGAA
SCHEMBL6538882 0.85 HPGD (0.40) ALDH1A1MAPTPPARDHPGD
SCHEMBL6233752 0.84 LMNA (0.50) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6538977 0.84 LMNA (0.50) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6207736 0.79 NPSR1 (0.54) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6539519 0.79 PPARD (0.47) NPSR1LMNAHTTALDH1A1PPARD
SCHEMBL6231803 0.78 PPARD (0.54) NPSR1LMNAHTTALDH1A1MAPT
SCHEMBL6540399 0.78 PPARD (0.54) NPSR1LMNAHTTALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583749-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE Astellas Pharma Inc. (JP) 2005-10-12 EP disclosed
US-20040157891-A1 Inhibitor of cox FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed
WO-2004065374-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE ASTELLAS PHARMA INC. (JP) 2004-08-05 WO 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-20040157891-A1 Inhibitor of cox PTGS1, PTGS2, PTGES2 NPSR1 884/4885LMNA 2620/4885HTT 3783/4885

“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.