SCHEMBL8073069

SCHEMBL8073069

NS(=O)(=O)c1ccc(-c2coc(=O)n2-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 1.00
PTGS1 P23219 16/20 0.75
KIF11 P52732 1/20 0.56

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
SCHEMBL8394966 0.88 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL4575048 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL4576392 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL2126159 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8068392 0.83 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL677082 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6725261 0.82 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL6732589 0.82 PTGS2 (0.69) PTGS2PTGS1
SCHEMBL5186811 0.82 PTGS2 (0.97) PTGS2PTGS1
SCHEMBL8074784 0.80 PTGS2 (1.00) 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-1017685-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL-PRODESFARMA, S.A. (ES) 2000-07-12 EP disclosed
WO-1999014205-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 1999-03-25 WO disclosed