SCHEMBL16690271

SCHEMBL16690271

C/C(=N/OC(=O)c1ccccc1)C(=O)c1ccc(-c2ccccc2[N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 6/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
HTT P42858 3/20 0.42
LMNA P02545 1/20 0.42
ADAMTS4 O75173 1/20 0.42
CDK5 Q00535 2/20 0.41
CDK5R1 Q15078 2/20 0.41
PKM P14618 1/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 3/20 0.41
XDH P47989 1/20 0.39
POLB P06746 2/20 0.38
MEN1 O00255 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
SCHEMBL16690226 0.89 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1TDP1L3MBTL1KMT2A
SCHEMBL16690265 0.89 CES2 (0.49) SMN1; SMN2ALDH1A1L3MBTL1KMT2AMAPT
SCHEMBL16690218 0.87 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1TDP1L3MBTL1KMT2A
SCHEMBL16690267 0.85 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1TDP1L3MBTL1KMT2A
SCHEMBL16690261 0.84 CES1 (0.56) SMN1; SMN2ALDH1A1L3MBTL1KMT2AMAPT
SCHEMBL16690163 0.83 ALDH1A1 (0.42) ALDH1A1TDP1L3MBTL1KMT2AMAPT
SCHEMBL16690269 0.81 KMT2A (0.41) ALDH1A1TDP1L3MBTL1KMT2AMAPT
SCHEMBL16690143 0.81 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1TDP1L3MBTL1KMT2A
SCHEMBL16690260 0.81 CES2 (0.43) SMN1; SMN2ALDH1A1TDP1L3MBTL1KMT2A
SCHEMBL16690259 0.81 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1TDP1KMT2AMAPT

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