SCHEMBL16690264

SCHEMBL16690264

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.40
MAPT P10636 5/20 0.40
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
MEN1 O00255 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
GLA P06280 1/20 0.36
ADAMTS4 O75173 1/20 0.36
KDM4E B2RXH2 2/20 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
SCHEMBL16690185 0.94 ALDH1A1 (0.41) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690248 0.91 ALDH1A1 (0.43) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690233 0.89 ALDH1A1 (0.39) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690269 0.89 KMT2A (0.41) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690196 0.87 MAPT (0.41) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690158 0.86 KMT2A (0.43) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690224 0.86 ALDH1A1 (0.43) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690267 0.84 ALDH1A1 (0.45) KMT2AMAPTALDH1A1TDP1HRH2
SCHEMBL16690273 0.84 MAPT (0.48) KMT2AMAPTALDH1A1TDP1MEN1
SCHEMBL16690193 0.84 ALDH1A1 (0.39) KMT2AALDH1A1TDP1HRH2HRH1

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