SCHEMBL6423536

SCHEMBL6423536

Cc1c(C(C(=O)O)C2CCC2)c2c(F)c(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
MGLL Q99685 1/20 0.37
PPARG P37231 8/20 0.37
EPHX2 P34913 1/20 0.37
PPARA Q07869 3/20 0.36
HRH3 Q9Y5N1 2/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
MAPK7 Q13164 2/20 0.35
PDE4B Q07343 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL6426016 0.98 HSD11B1 (0.38) HSD11B1MGLLPPARGEPHX2PPARA
SCHEMBL6423817 0.88 HSD11B1 (0.39) HSD11B1MGLLPPARGEPHX2PPARA
SCHEMBL6423103 0.88 AKR1C3 (0.39) MGLLPPARG
SCHEMBL6423593 0.86 HSD11B1 (0.39) HSD11B1MGLLPPARGEPHX2PPARA
SCHEMBL5798044 0.86 AKR1C3 (0.37) PPARGPTGDR2
SCHEMBL6427453 0.86 PPARG (0.37) PPARGPPARAHRH3PTGDR2
SCHEMBL6427479 0.86 MEN1 (0.36) HSD11B1MGLL
SCHEMBL6423869 0.86 AKR1C3 (0.39)
SCHEMBL5560433 0.85 PPARG (0.39) HSD11B1MGLLPPARGEPHX2PPARA
SCHEMBL6423768 0.85 PPARG (0.40) PPARGPPARA

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-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. 2005-10-20 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-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors FAAH2, FAAH, PTGES2 HSD11B1 1120/4885MGLL 108/4885PPARG 1908/4885

“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.