SCHEMBL13273307

SCHEMBL13273307

CCc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2)cc1C1=C(C)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.33
▸ CYP1B1 Q16678 1/20 0.33

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
SCHEMBL13273763 0.88 PDE3B (0.33) —
SCHEMBL12628971 0.88 PGR (0.38) —
SCHEMBL12129270 0.87 AHR (0.33) AHRCYP1B1
SCHEMBL12628470 0.83 FFAR1 (0.32) —
SCHEMBL12628831 0.81 NOTUM (0.33) —
SCHEMBL12628975 0.80 PTGS2 (0.34) —
SCHEMBL12129050 0.79 PGR (0.37) AHRCYP1B1
SCHEMBL13273761 0.78 PGR (0.38) —
SCHEMBL12129054 0.77 ACACB (0.35) —
SCHEMBL12129290 0.76 ESR1 (0.35) —

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-2010081688-A2 4-PHENYL-PYRANE-3,5-DIONES, 4-PHENYL-THIOPYRANE-3,5-DIONES AND CYCLOHEXANETRIONES AND THEIR USE AS INSECTICIDES, ACARICIDES AND/OR FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-07-22 — — WO disclosed
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