SCHEMBL14728016

SCHEMBL14728016

COC(=O)c1ccc(C=N)cc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.43
PDGFRB P09619 1/20 0.43
FGFR1 P11362 1/20 0.43
PDGFRA P16234 1/20 0.43
FLT1 P17948 1/20 0.43
FGFR3 P22607 1/20 0.43
KDR P35968 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
VCAM1 P19320 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
EGFR P00533 1/20 0.40
KDM4E B2RXH2 1/20 0.40
XDH P47989 1/20 0.40

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
SCHEMBL16954214 0.87 SIRT6 (0.44) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL14722272 0.87 ALDH5A1 (0.55) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL2390718 0.85 SIRT6 (0.46) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL15894148 0.83 MEN1 (0.54) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL14721537 0.83 MEN1 (0.54) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL14721536 0.83 MEN1 (0.54) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL28450330 0.81 MEN1 (0.44) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL1318248 0.80 ABCB1 (0.47) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL23044890 0.79 HTT (0.49) SIRT6PDGFRBFGFR1PDGFRAFLT1
SCHEMBL13236063 0.79 MAPT (0.53) MEN1KMT2AALDH1A1HPGDNPSR1

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
WO-2013026931-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO disclosed