SCHEMBL9704851

SCHEMBL9704851

O=C(Cl)c1ccc(OC(F)(F)F)cc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MITF O75030 1/20 0.43
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
CASP3 P42574 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
TDP1 Q9NUW8 2/20 0.39
TTR P02766 1/20 0.39
PPOX P50336 1/20 0.39
EIF4E P06730 1/20 0.39
DHODH Q02127 1/20 0.38
THRB P10828 1/20 0.38
HPD P32754 2/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL7683231 0.87 EIF4E (0.47) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL22749364 0.85 KMT2A (0.43) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL7688039 0.84 MEN1 (0.45) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL9299730 0.84 MAPT (0.41) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL1567614 0.80 NPC1 (0.53) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL707416 0.78 SMN1; SMN2 (0.51) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL31191383 0.78 MAPK1 (0.48) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL1275645 0.78 MAPK1 (0.48) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL3158027 0.78 MEN1 (0.57) MEN1KMT2ASMN1; SMN2MITFMAPT
SCHEMBL2323726 0.77 HPD (0.59) MEN1KMT2AMAPTHTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506907-A1 HETEROCYCLIC DIONE DERIVATIVES AS PESTICIDES AND PLANT GROWTH REGULATORS SANDOZ-ERFINDUNGEN Verwaltungsgesellschaft m.b.H. (AT) 1992-10-07 EP disclosed
WO-1992007837-A1 HETEROCYCLIC DIONE DERIVATIVES AS PESTICIDES AND PLANT GROWTH REGULATORS SANDOZ LTD. (CH) 1992-05-14 WO disclosed