SCHEMBL6976437

SCHEMBL6976437

Cc1cc(=O)c(-c2ccc(C(F)(F)F)cc2)c(-c2ccc(S(C)(=O)=O)cc2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 1.00
PTGS1 P23219 1/20 0.65

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
SCHEMBL1377265 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6975634 0.85 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6977125 0.84 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5708993 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5708933 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6975614 0.82 PTGS2 (0.83) PTGS2PTGS1
SCHEMBL6972681 0.81 PTGS2 (0.77) PTGS2PTGS1
SCHEMBL7259692 0.80 PTGS2 (0.67) PTGS2
SCHEMBL6968964 0.79 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6974584 0.79 PTGS2 (0.78) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115716-B1 2-PHENYLPYRAN-4-ONE DERIVATIVES ALMIRALL PRODESFARMA AG (CH) 2003-01-02 EP disclosed
US-20020045644-A1 2-phenylpyran-4-one derivatives LABORATORIES ALMIRALL, S.A. (ES) 2002-04-18 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-20020045644-A1 2-phenylpyran-4-one derivatives NR4A1, CYP3A4, HTR4 PTGS2 912/4885PTGS1 451/4885

“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.