SCHEMBL8626889

SCHEMBL8626889

N/C(=C/[N+](=O)[O-])c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
ALDH1A1 P00352 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
LMNA P02545 2/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 1/20 0.49
TLR4 O00206 1/20 0.45
TLR2 O60603 1/20 0.45
PRMT1 Q99873 1/20 0.44
TSHR P16473 2/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
PARP1 P09874 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL5067640 1.00 MAPT (0.49) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL5067634 1.00 MAPT (0.49) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL4067060 0.87 ALDH1A1 (0.40) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL4067059 0.87 ALDH1A1 (0.40) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL1160340 0.82 MAPT (0.45) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL3963190 0.80 L3MBTL1 (0.44) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL8629293 0.80 TSHR (0.67) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL8629294 0.80 TSHR (0.67) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL8629297 0.80 TSHR (0.67) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL10593265 0.78 TLR4 (0.47) MAPTALDH1A1L3MBTL1LMNAMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672646-B1 Process for producing beta-nitro-enamines and intermediates thereof SUMITOMO CHEMICAL CO (JP) 1998-06-10 EP disclosed
US-5639895-A Process for producing β-nitroenamine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-17 US disclosed
US-5597940-A REACTING NITROOLEFIN WITH HYDROXYLAMINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-01-28 US disclosed
EP-0672646-A1 Process for producing beta-nitro-enamines and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-09-20 EP disclosed