SCHEMBL4828783

SCHEMBL4828783

CCN(CC)C1Cc2cc(C)cc(-c3ccccc3C)c2O1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
DRD2 P14416 1/20 0.30
HTR7 P34969 1/20 0.30

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
SCHEMBL4970977 0.88 HTR1A (0.37) ALDH1A1HTR7
SCHEMBL5140412 0.79 AQP1 (0.37)
SCHEMBL4596946 0.78 BRD4 (0.38) ALDH1A1MAPK1
SCHEMBL4233581 0.77 PRKAB2 (0.46) SIRT2ALDH1A1MAPK1HTR7
SCHEMBL4596943 0.77 HTR7 (0.35) ALDH1A1MAPK1HTR7
SCHEMBL4971360 0.74 AQP1 (0.35) DRD2HTR7
SCHEMBL5606147 0.71 LMNA (0.35) ALDH1A1MAPK1HTR7
SCHEMBL4969988 0.70 AQP1 (0.46)
SCHEMBL4791170 0.69 AQP1 (0.39) SIRT2ALDH1A1MAPK1
SCHEMBL4863731 0.69 NUDT1 (0.39) DRD2

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
EP-1871356-A1 DIHYDROBENZOFURAN DERIVATIVES AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-01-02 EP claimed
WO-2006116170-A1 DIHYDROBENZOFURAN DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO claimed