SCHEMBL9321069

SCHEMBL9321069

CCCCCCCCCCCCCCCCC=CNC(=S)NCc1ccc(OCCN)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.52

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
SCHEMBL9321060 1.00 EPHX2 (0.52) EPHX2
SCHEMBL9321037 0.89 EPHX2 (0.57) EPHX2
SCHEMBL9321046 0.89 EPHX2 (0.57) EPHX2
SCHEMBL9321064 0.89
SCHEMBL9321888 0.86 EPHX2 (0.44) EPHX2
SCHEMBL9320950 0.84
SCHEMBL9320317 0.84
SCHEMBL6700457 0.82 EPHX2 (0.51) EPHX2
SCHEMBL9321739 0.82 EPHX2 (0.51) EPHX2
SCHEMBL9320977 0.82 EPHX2 (0.51) EPHX2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0282127-B1 Beta-aminoethyl-substituted phenyl compounds, and anti-inflammatory or analgesic compositions containing them PROCTER & GAMBLE (US) 1994-02-02 EP disclosed
US-5099030-A Phenols or phenolic ethers THE PROCTER & GAMBLE COMPANY (US) 1992-03-24 US disclosed
US-5045565-A Novel compounds, pharmaceutical compositions, and methods for treating inflammation and pain THE PROCTER & GAMBLE COMPANY (US) 1991-09-03 US disclosed