SCHEMBL9711027

SCHEMBL9711027

COCc1ccc2c(c1)C(OC(C)=O)=CC2=Cc1ccc([S+](C)[O-])cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.33
MAPT P10636 1/20 0.32
PTGS1 P23219 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 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
SCHEMBL9711024 0.82 PPARG (0.53) PPARGPTGS1
SCHEMBL11884029 0.81 KMT2A (0.37) PPARGMAPTPTGS1POLBKMT2A
SCHEMBL11884952 0.66 HTR6 (0.42) PPARGMAPTPTGS1POLBKMT2A
SCHEMBL23095539 0.66 PTGS2 (0.37)
SCHEMBL13236875 0.66 PTGS2 (0.37)
SCHEMBL23396563 0.66 PTGS2 (0.37)
SCHEMBL4548508 0.64 PPARG (0.73) PPARGPTGS1
SCHEMBL8681338 0.64 PPARG (0.38) PPARGMAPTKMT2A
SCHEMBL9621642 0.63 PPARG (0.54) PPARGPTGS1
SCHEMBL7632675 0.62 PPARG (0.39) PPARGMAPTKMT2A

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
EP-0485172-A2 Esters and amides of substituted indenyl acetic acids FGN, INC. (US) 1992-05-13 EP disclosed