SCHEMBL8224424

SCHEMBL8224424

FC(F)(F)c1nccc(CI)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 3/20 0.42
IDH1 O75874 5/20 0.36
IDH2 P48735 4/20 0.36
LOXL2 Q9Y4K0 2/20 0.34
LOX P28300 1/20 0.34
GRM2 Q14416 6/20 0.32
TAS2R14 Q9NYV8 1/20 0.31
AAK1 Q2M2I8 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
Hydrochloric Acid SCHEMBL30798663 0.82 LOXL2 (0.44) MALT1IDH1IDH2LOXL2LOX
Hydrochloric Acid SCHEMBL20815622 0.82 MALT1 (0.41) MALT1IDH1IDH2LOXL2LOX
Hydrochloric Acid SCHEMBL30813051 0.82 MALT1 (0.41) MALT1IDH1IDH2LOXL2LOX
SCHEMBL19583716 0.80 MALT1 (0.42) MALT1IDH1IDH2LOXL2GRM2
SCHEMBL8171795 0.80 IDH1 (0.42) MALT1IDH1IDH2GRM2AAK1
SCHEMBL3662853 0.80 MALT1 (0.42) MALT1IDH1IDH2GRM2
SCHEMBL13162796 0.80 LOXL2 (0.43) MALT1IDH1IDH2LOXL2LOX
SCHEMBL8225228 0.77 IDH1 (0.40) MALT1IDH1IDH2
SCHEMBL17109739 0.77 MALT1 (0.40) MALT1IDH1IDH2GRM2AAK1
SCHEMBL24108548 0.76 MALT1 (0.39) MALT1IDH1IDH2GRM2TAS2R14

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
WO-2008002671-A2 METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-01-03 WO disclosed