SCHEMBL10285367

SCHEMBL10285367

COCCNc1c(N=O)cc(C(=O)OC)c2c1CC(C)(C)O2

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.31
EZH2 Q15910 1/20 0.31
ALOX5 P09917 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
PTGES O14684 4/20 0.30

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
SCHEMBL2698809 0.85 NPC1 (0.39) NPC1ALDH1A1EZH2ALOX5PTGS1
SCHEMBL2695937 0.83 LMNA (0.42) NPC1ALDH1A1
SCHEMBL5525636 0.76 NPC1 (0.39) NPC1ALDH1A1EZH2ALOX5PTGS1
SCHEMBL5517552 0.75 LMNA (0.42) NPC1ALDH1A1
SCHEMBL2698798 0.70 KDM4E (0.40) ALDH1A1
SCHEMBL2697504 0.69 PDGFRB (0.39) ALDH1A1
SCHEMBL8685016 0.68 PTGES (0.38) ALDH1A1ALOX5PTGES
SCHEMBL2699346 0.68 ALDH1A1 (0.41) NPC1ALDH1A1
SCHEMBL2697658 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL2697916 0.65 PDGFRB (0.39) ALDH1A1

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-20120108583-A1 Tricyclic Compounds As mPGES-1 Inhibitors GLENMARK PHARMACEUTICALS S.A. (CH) 2012-05-03 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-20120108583-A1 Tricyclic Compounds As mPGES-1 Inhibitors PTGES, PTGS1, PTGIS NPC1 506/4885ALDH1A1 263/4885EZH2 4024/4885

“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.