SCHEMBL7915385

SCHEMBL7915385

COc1ccc(Cc2ccc(F)cc2)c(F)c1-c1cccc(NO)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK10 O94804 1/20 0.39
SLK Q9H2G2 1/20 0.39
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
GAA P10253 2/20 0.37
PDE4B Q07343 1/20 0.36
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ELANE P08246 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 1/20 0.35
ERN1 O75460 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL8070659 0.89 STK10 (0.38) STK10SLKKMT2AMEN1MAPT
SCHEMBL7916008 0.87 PDE4D (0.52) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL7914966 0.86 PDE4D (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL8057832 0.84 PDE4D (0.49) KMT2AMEN1MAPTGAAPDE4B
SCHEMBL8067401 0.82 ALDH1A1 (0.42) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL8066904 0.80 PDE4D (0.54) STK10SLKKMT2AMEN1MAPT
SCHEMBL16158918 0.78 SMN1; SMN2 (0.40) KMT2AMEN1MAPTSMN1; SMN2HTR1A
SCHEMBL8071506 0.78 PDE4B (0.48) STK10SLKKMT2AMEN1MAPT
SCHEMBL4326854 0.77 PDE4D (0.48) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL8066265 0.77 HTR1A (0.46) STK10SLKKMT2AMAPTHTR1A

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-2010059838-A2 PDE4 INHIBITORS SELECTIVE FOR THE LONG FORM OF PDE4 FOR TREATING INFLAMMATION AND AVOIDING SIDE EFFECTS DECODE GENETICS EHF (IS) 2010-05-27 WO disclosed