SCHEMBL6279767

SCHEMBL6279767

On1nnc2c(Br)cc(Br)cc21.On1nnc2c(Cl)cc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 4/20 0.42
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL3278014 0.86 MAPK1 (0.37) GRM2MAPTMAPK1
SCHEMBL3286257 0.86 GRM2 (0.50) GRM2MAPTMAPK1
SCHEMBL10918221 0.69 MAPK1 (0.36) GRM2MAPTMAPK1
SCHEMBL6276463 0.65 MAPT (0.40) GRM2MAPTMAPK1
SCHEMBL3285305 0.65 MAPK1 (0.37) MAPTMAPK1
SCHEMBL3283730 0.64 MAPT (0.65) MAPTMAPK1
SCHEMBL3278985 0.64 MAPT (0.65) MAPTMAPK1
SCHEMBL3284952 0.64 MAPT (0.50) GRM2MAPTMAPK1
SCHEMBL31364820 0.63 LMNA (0.39) —
SCHEMBL3282850 0.62 GRM2 (0.50) GRM2MAPTMAPK1

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-1606447-A1 OXIDATION SYSTEM CONTAINING A MACROCYCLIC METAL COMPLEX, THE PRODUCTION THEREOF AND ITS USE Lanxess B.V. (NL) 2005-12-21 — — EP disclosed
WO-2004083516-A1 OXIDATION SYSTEM CONTAINING A MACROCYCLIC METAL COMPLEX, THE PRODUCTION THEREOF AND ITS USE LANXESS B.V. (NL) 2004-09-30 — — WO disclosed
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