SCHEMBL6232465

SCHEMBL6232465

COc1ccc(-c2nc(C(F)F)oc2-c2ccc(OCCNC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SUCNR1 Q9BXA5 11/20 0.47
CA12 O43570 5/20 0.46
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA9 Q16790 5/20 0.46
BCHE P06276 1/20 0.42
CNR2 P34972 1/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
PDK2 Q15119 1/20 0.40

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
SCHEMBL6540393 1.00 SUCNR1 (0.47) SUCNR1CA12CA1CA2CA9
SCHEMBL6540479 0.88 MTNR1A (0.45) MTNR1AMTNR1B
SCHEMBL6540499 0.88 MTNR1A (0.57) MTNR1AMTNR1B
SCHEMBL6538972 0.88 MTNR1A (0.45) MTNR1AMTNR1B
SCHEMBL6540430 0.87 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL6538927 0.87 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL6539700 0.83 SUCNR1 (0.46) SUCNR1CA12CA1CA2CA9
SCHEMBL6229912 0.81 PPARD (0.40)
SCHEMBL6538959 0.81 PPARD (0.40)
SCHEMBL6538879 0.80 CA12 (0.43) SUCNR1CA12CA1CA2CA9

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 SUCNR1 233/4885CA12 3116/4885CA1 1632/4885

“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.