SCHEMBL16690180

SCHEMBL16690180

CCCC(=O)O/N=C(\C(=O)c1ccc(-c2ccccc2[N+](=O)[O-])cc1)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
ALDH1A1 P00352 7/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL16690167 0.99 ALDH1A1 (0.40) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690199 0.95 MAPT (0.39) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690203 0.94 MAPT (0.39) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690145 0.93 ALDH1A1 (0.39) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690234 0.92 HRH2 (0.38) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690216 0.88 MAPT (0.45) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL16690139 0.88 ALDH1A1 (0.39) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690162 0.87 ALDH1A1 (0.44) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL16690187 0.86 ALDH1A1 (0.40) MAPTALDH1A1KMT2AMEN1HRH2
SCHEMBL16690209 0.86 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1TDP1LMNA

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