SCHEMBL22564075

SCHEMBL22564075

NNC(=O)N(N)c1cccc(Br)c1I

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
STAT3 P40763 1/20 0.31
STAT1 P42224 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
OGG1 O15527 1/20 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
SCHEMBL19904127 0.81 ALDH1A1 (0.33) MEN1NPC1ALDH1A1LMNAGAA
SCHEMBL22563994 0.81 MAPT (0.33) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL22563901 0.81 OGG1 (0.34) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL22563922 0.78
SCHEMBL19909972 0.78 NPC1 (0.32) MEN1NPC1ALDH1A1LMNAGAA
SCHEMBL22563847 0.77 GAA (0.30) ALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL22564441 0.77 LMNA (0.34) MEN1NPC1ALDH1A1LMNAGAA
SCHEMBL22563814 0.77 CTSD (0.43) MEN1ALDH1A1LMNAGAAMAPT
SCHEMBL22564247 0.77
SCHEMBL22564257 0.77

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed