SCHEMBL6569045

SCHEMBL6569045

CCC(N1C(=O)c2c(Br)c(Br)c(Br)c(Br)c2C1=O)N1C(=O)c2c(Br)c(Br)c(Br)c(Br)c2C1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA7 P43166 2/20 0.31
TSHR P16473 1/20 0.31
HIPK2 Q9H2X6 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
SCHEMBL2769359 0.75 TSHR (0.35) CA9CA12CA1CA2CA7
SCHEMBL10935467 0.75 USP2 (0.37) CA9CA12CA1CA2CA7
SCHEMBL9331108 0.72 TSHR (0.36) CA9CA12CA1CA2CA7
SCHEMBL3692053 0.70 F2 (0.43) CA9CA12CA1CA2CA7
SCHEMBL5096156 0.69 CA12 (0.35) CA9CA12CA1CA2CA7
SCHEMBL10933086 0.67 CA9 (0.44) CA9CA12CA1CA2CA7
SCHEMBL9331394 0.66 CA12 (0.37) CA9CA12CA1CA2CA7
SCHEMBL3687476 0.66 TSHR (0.39) CA9CA12CA1CA2CA7
SCHEMBL10434423 0.65 MEN1 (0.44) CA9CA12CA1CA2CA7
SCHEMBL10935097 0.65 CA9 (0.38) CA9CA12CA1CA2CA7

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
EP-1405879-A1 FLAME RETARDANT POLYETHYLENE TEREPHTHALATE RESIN COMPOSITION Win Tech Polymer Ltd. (JP) 2004-04-07 EP disclosed