SCHEMBL11544480

SCHEMBL11544480

[O-][n+]1cc(Br)cc(Oc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.44
TSHR P16473 1/20 0.44
LMNA P02545 1/20 0.40
SOS1 Q07889 1/20 0.39
PABPC1 P11940 1/20 0.38
EIF4H Q15056 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
PGR P06401 1/20 0.38
MAOB P27338 2/20 0.37
NR1H2 P55055 1/20 0.36
BAX Q07812 1/20 0.36
MAOA P21397 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RHEB Q15382 1/20 0.36
GSTP1 P09211 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MCL1 Q07820 1/20 0.35

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
SCHEMBL1680656 0.73 LTA4H (0.60) LTA4HTSHRLMNASOS1PABPC1
SCHEMBL23392270 0.73 LTA4H (0.60) LTA4HTSHRLMNAPGRMAOB
SCHEMBL16890030 0.73 LTA4H (0.60) LTA4HTSHRPGRMAOBNR1H2
SCHEMBL7263349 0.72 LTA4H (0.52) LTA4HTSHRLMNASOS1PABPC1
SCHEMBL30020579 0.71 LTA4H (0.57) LTA4HTSHRPGRMAOBNR1H2
SCHEMBL5434 0.71 LTA4H (0.57) LTA4HTSHRPGRMAOBNR1H2
SCHEMBL5776467 0.71 ALDH1A1 (0.44) TSHRHTTSMN1; SMN2CA1CA2
Diphenylether SCHEMBL27982791 0.70 LTA4H (0.71) LTA4HTSHRSOS1PGRMAOB
SCHEMBL9817938 0.70 MAOB (0.55) LTA4HTSHRPGRMAOBHTT
SCHEMBL7265752 0.70 MAOB (0.55) LTA4HTSHRPGRMAOBHTT

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
US-4179563-A COGNITION ACTIVATORS WARNER-LAMBERT COMPANY (US) 1979-12-18 US disclosed