SCHEMBL19909972

SCHEMBL19909972

NNC(=O)N(N)c1cccc(Br)c1CBr

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
OGG1 O15527 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL19909909 0.84 LMNA (0.37) NPC1ALDH1A1MEN1LMNAGAA
SCHEMBL22059497 0.83 ALDH1A1 (0.34) NPC1ALDH1A1MEN1LMNAGAA
SCHEMBL20195474 0.82 ALOX15 (0.35) ALDH1A1LMNAGAAMAPTKDM4E
SCHEMBL22038786 0.80 CTSD (0.43) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL20342686 0.80 P2RX7 (0.35) ALDH1A1MEN1LMNAGAAMAPT
SCHEMBL21317950 0.79 NOTUM (0.32)
SCHEMBL18831729 0.79 HPGD (0.31)
SCHEMBL22564075 0.78 MEN1 (0.31) NPC1ALDH1A1MEN1LMNAGAA
SCHEMBL19904127 0.78 ALDH1A1 (0.33) NPC1ALDH1A1MEN1LMNAGAA
SCHEMBL20195546 0.77 L3MBTL1 (0.32) NPC1ALDH1A1MEN1LMNAGAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3059235-B1 TETRAZOLINONE DERIVATIVES AND THEIR USE FOR CONTROLLING PESTS SUMITOMO CHEMICAL CO (JP) 2020-10-28 EP disclosed
EP-2990404-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-05-27 EP disclosed
EP-3025585-B1 PLANT DISEASE CONTROL COMPOSITION AND ITS USE SUMITOMO CHEMICAL CO (JP) 2018-02-28 EP disclosed