SCHEMBL4786220

SCHEMBL4786220

Cn1c(CBr)nnc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.35
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 1/20 0.33
SCN5A Q14524 2/20 0.30

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
SCHEMBL13104703 0.81 MAPT (0.38) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL29245722 0.79 MAPT (0.41) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL11339077 0.79 MAPT (0.37) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL1976593 0.78 MAPT (0.36) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL16363146 0.77 MAPT (0.42) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL4101014 0.76 SMN1; SMN2 (0.38) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL4785865 0.69 MAPT (0.38) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL13093073 0.69 MAPT (0.38) MAPTRECQLMEN1TSHRKMT2A
SCHEMBL13095083 0.65
SCHEMBL13814459 0.65 MAPT (0.50) MAPTRECQLMEN1TSHRKMT2A

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-2008074991-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-06-26 WO disclosed