SCHEMBL12090486

SCHEMBL12090486

C1=C\CC2Oc3ccc(P(c4ccccc4)c4ccccc4)c(c3O2)-c2c(P(c3ccccc3)c3ccccc3)ccc3c2OC(C/1)O3

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
DRD1 P21728 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
SCHEMBL16843112 1.00 CYP3A4 (0.31) CYP3A4TDP1DRD1
SCHEMBL18430360 0.85 CYP3A4 (0.31) CYP3A4TDP1DRD1
SCHEMBL12090286 0.81 DRD1 (0.31) DRD1
SCHEMBL16843111 0.81 DRD1 (0.31) DRD1
SCHEMBL18430362 0.81 DRD1 (0.31) DRD1
SCHEMBL18430361 0.81 DRD1 (0.31) DRD1
SCHEMBL12093787 0.81 DRD1 (0.31) DRD1
SCHEMBL18430359 0.81 DRD1 (0.31) DRD1
SCHEMBL12090488 0.78
SCHEMBL16843107 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9035003-B2 High capacity magnetic nanoparticles as supports for reagents and catalysts THE UNIVERSITY OF KANSAS (US) 2015-05-19 US disclosed
US-9035003-B2 High capacity magnetic nanoparticles as supports for reagents and catalysts THE UNIVERSITY OF KANSAS (US) 2015-05-19 US disclosed
US-20120226007-A1 HIGH CAPACITY MAGNETIC NANOPARTICLES AS SUPPORTS FOR REAGENTS AND CATALYSTS THE UNIVERSITY OF KANSAS (US) 2012-09-06 US disclosed
US-20120226007-A1 HIGH CAPACITY MAGNETIC NANOPARTICLES AS SUPPORTS FOR REAGENTS AND CATALYSTS THE UNIVERSITY OF KANSAS (US) 2012-09-06 US disclosed