SCHEMBL7446435

SCHEMBL7446435

O=CC1COc2c(cc(Cl)c(Cl)c2Cl)O1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.37

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
SCHEMBL7434642 0.86
SCHEMBL7437647 0.80 CA2 (0.44) AHR
SCHEMBL7446440 0.74 GAA (0.37) AHR
SCHEMBL7444491 0.73 CA2 (0.40)
SCHEMBL7432845 0.73 LMNA (0.35)
SCHEMBL2524829 0.71 CA2 (0.49) AHR
SCHEMBL7434309 0.69 CA2 (0.48) AHR
SCHEMBL2487394 0.69 CA2 (0.48) AHR
SCHEMBL7438079 0.68
SCHEMBL7436351 0.66 AHR (0.33) AHR

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
US-4558129-A Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade SYNTEX (U.S.A.) INC. (US) 1985-12-10 US disclosed
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed