SCHEMBL9256975

SCHEMBL9256975

Cc1cc(=O)c(-c2ccc(Oc3ccc(S(C)(=O)=O)cc3)cc2)c(C)o1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.60
PTGS1 P23219 1/20 0.60

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
SCHEMBL9269944 0.83 EGFR (0.49) PTGS2PTGS1
SCHEMBL9264843 0.82 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL9265538 0.82 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL9268153 0.81 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL9255564 0.80 ACHE (0.41) PTGS2PTGS1
SCHEMBL9268345 0.78 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL9282952 0.78 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL9266183 0.78 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL9271420 0.78 MAPT (0.51) PTGS2
SCHEMBL9255571 0.77 PTGS2 (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5403934-A Heterocyclic compounds BURROUGHS WELLCOME CO. (US) 1995-04-04 US disclosed