SCHEMBL4629033

SCHEMBL4629033

CCCCCCCCCSc1ccc([O])c(C2CCCCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.39
CNR1 P21554 4/20 0.37
CNR2 P34972 4/20 0.37
THRA P10827 1/20 0.37
ATM Q13315 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PLK1 P53350 3/20 0.34

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
SCHEMBL200571 0.85 THRB (0.39) THRBCNR1CNR2THRAATM
SCHEMBL202845 0.85 THRB (0.39) THRBCNR1CNR2THRAATM
SCHEMBL202846 0.80 CNR1 (0.45) THRBCNR1CNR2ATM
SCHEMBL200572 0.80 CNR1 (0.45) THRBCNR1CNR2ATM
SCHEMBL201687 0.79 CNR1 (0.35) THRBCNR1CNR2ATMALDH1A1
SCHEMBL4628593 0.74 THRB (0.48) THRBCNR2THRAPLK1
SCHEMBL3466997 0.74 THRB (0.48) THRBCNR2THRAPLK1
SCHEMBL201688 0.73 CNR1 (0.41) THRBCNR1CNR2ATMALDH1A1
SCHEMBL4628805 0.72 THRB (0.45) THRBCNR2THRAPLK1
SCHEMBL21575598 0.69 THRB (0.56) THRBTHRAPLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1927141-A2 FLUORESCENT SOLAR CONVERSION CELLS BASED ON FLUORESCENT TERYLENE DYES BASF SE (DE) 2008-06-04 EP disclosed
EP-1917311-A2 MULTIPLE CHROMOPHORES BASF SE (DE) 2008-05-07 EP disclosed
EP-1904497-A1 SUBSTITUTED RYLENE DERIVATIVES BASF SE (DE) 2008-04-02 EP disclosed
WO-2007031446-A2 FLUORESCENT SOLAR CONVERSION CELLS BASED ON FLUORESCENT TERYLENE DYES BASF SE (DE) 2007-03-22 WO disclosed
WO-2007014902-A2 MULTIPLE CHROMOPHORES BASED ON RYLENE BASF SE (DE) 2007-02-08 WO disclosed
WO-2007006717-A1 SUBSTITUTED RYLENE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2007-01-18 WO disclosed