SCHEMBL8520293

SCHEMBL8520293

C=CC(C=NO)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.36
LMNA P02545 4/20 0.35
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MAPT P10636 3/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP3A4 P08684 2/20 0.33
ALOX15 P16050 2/20 0.33
CYP2D6 P10635 1/20 0.32
SRC P12931 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
DPP4 P27487 2/20 0.31
TSHR P16473 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
SCHEMBL41440 0.79 TSHR (0.41) CYP2C19LMNAALDH1A1MAPTKDM4E
SCHEMBL8168566 0.75 CYP2C19 (0.36) CYP2C19LMNAMAPK1ALDH1A1MAPT
SCHEMBL4632000 0.73 NPSR1 (0.42) LMNAMAPK1ALDH1A1MAPTGAA
SCHEMBL4631998 0.73 NPSR1 (0.42) LMNAMAPK1ALDH1A1MAPTGAA
SCHEMBL10747253 0.71 CYP2C19 (0.35) CYP2C19LMNAALDH1A1MAPTKDM4E
SCHEMBL1583342 0.71 LMNA (0.44) LMNAMAPK1ALDH1A1MAPTGAA
SCHEMBL21410131 0.71 CYP2C19 (0.35) CYP2C19LMNAALDH1A1MAPTKDM4E
SCHEMBL1583344 0.71 LMNA (0.44) LMNAMAPK1ALDH1A1MAPTGAA
Methoxymethane SCHEMBL28327775 0.71 MAPT (0.41) CYP2C19LMNAALDH1A1MAPTKDM4E
SCHEMBL1335929 0.71 CYP2D6 (0.41) CYP2C19LMNAMAPK1ALDH1A1MAPT

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
US-5879556-A Method of recovering extractant HENKEL CORPORATION 1999-03-09 US disclosed
WO-1996022822-A1 METHOD OF RECOVERING EXTRACTANT HENKEL CORPORATION (US) 1996-08-01 WO disclosed