SCHEMBL6832647

SCHEMBL6832647

O=P(O)([Se]C1CCCCC1)[Se]C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.37
CA12 O43570 6/20 0.37
CA1 P00915 6/20 0.37
CA2 P00918 6/20 0.37
CA9 Q16790 6/20 0.37
MMP1 P03956 4/20 0.37
MMP8 P22894 3/20 0.37
MMP3 P08254 2/20 0.37
FDPS P14324 1/20 0.37
MMP9 P14780 1/20 0.33
METAP1 P53582 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
ANPEP P15144 2/20 0.31
ERAP2 Q6P179 2/20 0.31
ALDH1A1 P00352 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
SCHEMBL6827925 0.74
SCHEMBL5059554 0.71 MMP2 (0.36) MMP2CA12CA1CA2CA9
Biphenyl SCHEMBL8370297 0.65 ALDH1A1 (0.53) MMP2CA12CA1CA2CA9
SCHEMBL11770725 0.65 MMP2 (0.38) MMP2CA12CA1CA2CA9
SCHEMBL15105606 0.63 ACHE (0.50) MMP2CA12CA1CA2CA9
SCHEMBL18486452 0.63 ACHE (0.50) MMP2CA12CA1CA2CA9
SCHEMBL270557 0.63 ACHE (0.50) MMP2CA12CA1CA2CA9
SCHEMBL968968 0.63 MMP2 (0.41) MMP2CA12CA1CA2CA9
SCHEMBL18261819 0.63 MMP2 (0.41) MMP2CA12CA1CA2CA9
SCHEMBL585039 0.63 MMP2 (0.41) MMP2CA12CA1CA2CA9

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-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed