SCHEMBL22564058

SCHEMBL22564058

CN(N)C(=O)N(N)c1cccc(C(F)(F)F)c1I

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.34
POLQ O75417 1/20 0.34
P2RX7 Q99572 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
TAS2R14 Q9NYV8 1/20 0.31
SLC6A9 P48067 1/20 0.31
SCN9A Q15858 1/20 0.30
NFKB1 P19838 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30
ESR1 P03372 1/20 0.30
PTGS1 P23219 1/20 0.30
GPBAR1 Q8TDU6 1/20 0.30
MAPT P10636 1/20 0.30
TP53 P04637 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
SCHEMBL18831416 0.84 TAS2R14 (0.40) NOTUMPOLQP2RX7LMNAGAA
SCHEMBL22563802 0.80 TDP1 (0.35) SMN1; SMN2GAAMAPTTP53
SCHEMBL22564441 0.79 LMNA (0.34) NOTUMP2RX7SMN1; SMN2LMNAGAA
SCHEMBL22564095 0.79 L3MBTL1 (0.32)
SCHEMBL18831396 0.79 POLQ (0.35) NOTUMPOLQESR1MAPT
SCHEMBL22563977 0.79 GPBAR1 (0.34) GAASCN9AGPBAR1
SCHEMBL22564432 0.78 MYC (0.34) SMN1; SMN2LMNAGAAMAPTTP53
SCHEMBL22564454 0.78
SCHEMBL22564438 0.78 CA12 (0.39) NOTUMLMNAMAPTTP53
SCHEMBL22563887 0.77 AOC3 (0.34) NOTUMSMN1; SMN2GAAMAPTTP53

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