SCHEMBL16690195

SCHEMBL16690195

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

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 1/20 0.51
CTNNB1 P35222 1/20 0.51
MAPT P10636 8/20 0.46
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
CES1 P23141 2/20 0.45
MAPK1 P28482 2/20 0.43
POLB P06746 3/20 0.42
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CES2 O00748 1/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL16690228 0.93 MAPT (0.49) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690249 0.90 CES1 (0.47) MAPTALDH1A1KMT2AMEN1CES1
SCHEMBL16690178 0.88 ALDH1A1 (0.42) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690157 0.88 BCL9 (0.53) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690184 0.87 BCL9 (0.50) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690221 0.84 CES1 (0.53) MAPTALDH1A1KMT2AMEN1CES1
SCHEMBL16690189 0.84 MAPT (0.50) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690163 0.83 ALDH1A1 (0.42) BCL9CTNNB1MAPTALDH1A1KMT2A
SCHEMBL16690272 0.82 ALDH1A1 (0.47) MAPTALDH1A1KMT2AMEN1MAPK1
SCHEMBL16690177 0.81 ALDH1A1 (0.53) BCL9CTNNB1MAPTALDH1A1KMT2A

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