SCHEMBL8972155

SCHEMBL8972155

CCCCC/C=C/C1COC(c2ccc(-c3ccc(F)c(F)c3)cc2)OC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.32
PDE5A O76074 1/20 0.32
RARB P10826 2/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
ESR2 Q92731 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8972146 1.00 GCGR (0.32) GCGRPDE5ARARBRARARARG
SCHEMBL9312574 1.00 GCGR (0.32) GCGRPDE5ARARBRARARARG
SCHEMBL9312572 1.00 GCGR (0.32) GCGRPDE5ARARBRARARARG
SCHEMBL9311991 0.92 CYP11B1 (0.31)
SCHEMBL8972392 0.92 CYP11B1 (0.31)
SCHEMBL8972400 0.92 CYP11B1 (0.31)
SCHEMBL9311996 0.92 CYP11B1 (0.31)
SCHEMBL9313050 0.87 CYP11B1 (0.32)
SCHEMBL8972651 0.87 CYP11B1 (0.32)
SCHEMBL9313045 0.87 CYP11B1 (0.32)

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-0433836-B1 Halophenyl substituted dioxanes HOFFMANN LA ROCHE (CH) 1996-03-27 EP disclosed
US-5322638-A Halophenyl substituted dioxanes HOFFMANN-LA ROCHE INC. (US) 1994-06-21 US disclosed
EP-0433836-A2 Halophenyl substituted dioxanes F. HOFFMANN-LA ROCHE AG (CH) 1991-06-26 EP disclosed