SCHEMBL15077167

SCHEMBL15077167

C=C1OB(C2=Cc3ccccc3C2)OC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.31

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
SCHEMBL4312526 0.79 LPL (0.40) PTGS2
SCHEMBL29606598 0.79 LPL (0.40) PTGS2
SCHEMBL15079671 0.77 MAOA (0.34) PTGS2
SCHEMBL13184458 0.70 LPL (0.43)
SCHEMBL13474635 0.67 LPL (0.38)
SCHEMBL20169917 0.66 PTGS2 (0.36) PTGS2
SCHEMBL19058619 0.66 PTGS2 (0.36) PTGS2
SCHEMBL13186080 0.65 LPL (0.34)
SCHEMBL14606867 0.65
SCHEMBL21247346 0.65 P2RX7 (0.42) PTGS2

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
WO-2013091837-A1 PROCESS FOR THE PREPARATION OF METALLOCENE COMPLEXES SAUDI BASIC INDUSTRIES CORPORATION (SABIC) (SA) 2013-06-27 WO disclosed