SCHEMBL16690158

SCHEMBL16690158

CCCCC(=O)O/N=C(\C)c1ccc(-c2ccccc2[N+](=O)[O-])cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.43
MEN1 O00255 4/20 0.43
MAPT P10636 4/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
GLA P06280 1/20 0.38
ADAMTS4 O75173 1/20 0.38
ALPI P09923 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL16690154 0.96 KMT2A (0.46) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690174 0.93 ALDH1A1 (0.43) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690269 0.89 KMT2A (0.41) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690164 0.89 TDP1 (0.46) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690159 0.86 ALDH1A1 (0.48) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690264 0.86 KMT2A (0.40) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690196 0.85 MAPT (0.41) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690155 0.84 ALDH1A1 (0.50) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690166 0.83 MAPT (0.51) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL16690163 0.83 ALDH1A1 (0.42) KMT2AMEN1MAPTALDH1A1TDP1

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-2015064958-A1 NOVEL OXIME ESTER BIPHENYL COMPOUND, PHOTO INITIATOR AND PHOTOSENSITIVE RESIN COMPOSITION CONTAINING SAME 한국화학연구원 2015-05-07 WO disclosed