SCHEMBL16690155

SCHEMBL16690155

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ADAMTS4 O75173 1/20 0.43
KMT2A Q03164 2/20 0.42
ALPI P09923 1/20 0.42
AVPR2 P30518 1/20 0.40
AVPR1A P37288 1/20 0.40
MAPT P10636 3/20 0.40
PKM P14618 1/20 0.40
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
MAOB P27338 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
SLC9A1 P19634 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL16690164 0.88 TDP1 (0.46) ALDH1A1TDP1ADAMTS4KMT2AALPI
SCHEMBL16690245 0.87 ALDH1A1 (0.51) ALDH1A1TDP1ADAMTS4KMT2AAVPR2
SCHEMBL16690226 0.87 ALDH1A1 (0.48) ALDH1A1TDP1ADAMTS4KMT2AALPI
SCHEMBL16690174 0.86 ALDH1A1 (0.43) ALDH1A1TDP1ADAMTS4KMT2AALPI
SCHEMBL16690143 0.84 ALDH1A1 (0.48) ALDH1A1TDP1ADAMTS4KMT2AAVPR2
SCHEMBL16690158 0.84 KMT2A (0.43) ALDH1A1TDP1ADAMTS4KMT2AALPI
SCHEMBL16690171 0.84 TTR (0.40) ALDH1A1KMT2AALPIMAPTLMNA
SCHEMBL16690224 0.83 ALDH1A1 (0.43) ALDH1A1TDP1ADAMTS4KMT2AAVPR2
SCHEMBL16690154 0.82 KMT2A (0.46) ALDH1A1TDP1KMT2AMAPTHRH2
SCHEMBL16690244 0.81 ALDH1A1 (0.41) ALDH1A1TDP1ADAMTS4KMT2AAVPR2

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