SCHEMBL16690152

SCHEMBL16690152

CCCCCCCC(=O)O/N=C(\C)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
MAPT P10636 9/20 0.49
KMT2A Q03164 5/20 0.49
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
MEN1 O00255 3/20 0.45
LMNA P02545 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CDC25B P30305 3/20 0.43
BCL9 O00512 1/20 0.43
CTNNB1 P35222 1/20 0.43
MGLL Q99685 1/20 0.43
MAPK1 P28482 1/20 0.41

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
SCHEMBL16690166 0.95 MAPT (0.51) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690157 0.90 BCL9 (0.53) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690149 0.88 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690172 0.85 MAPK1 (0.47) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL16690228 0.84 MAPT (0.49) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690154 0.84 KMT2A (0.46) ALDH1A1MAPTKMT2AMEN1
SCHEMBL16690159 0.83 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690176 0.83 ALDH1A1 (0.50) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690156 0.81 ALDH1A1 (0.51) ALDH1A1MAPTKMT2AHDAC3HDAC1
SCHEMBL16690273 0.81 MAPT (0.48) ALDH1A1MAPTKMT2AHDAC3HDAC1

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