SCHEMBL16690156

SCHEMBL16690156

CCCCCCC(=NOC(C)=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 8/20 0.44
KMT2A Q03164 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
MGLL Q99685 2/20 0.43
HDAC3 O15379 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 0.43
MEN1 O00255 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 1/20 0.41
BCL9 O00512 1/20 0.40
CTNNB1 P35222 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 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
SCHEMBL16690160 0.95 MAPT (0.45) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL9962618 0.90 ALDH1A1 (0.48) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL16690176 0.90 ALDH1A1 (0.50) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL16690182 0.85 MAPK1 (0.47) ALDH1A1MAPTKMT2AMEN1MAPK1
SCHEMBL16690175 0.85 HDAC3 (0.46) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL16690152 0.81 ALDH1A1 (0.51) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL17973404 0.81 MAPK1 (0.45) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL22155761 0.80 CNR1 (0.40) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL9962627 0.78 MAPT (0.45) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL16690170 0.77 MAPK1 (0.53) ALDH1A1MAPTKMT2ALMNAMEN1

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