SCHEMBL8566358

SCHEMBL8566358

COC/C=C/c1ncccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 4/20 0.43
PDE10A Q9Y233 1/20 0.43
LMNA P02545 1/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
RAB9A P51151 4/20 0.42
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PAX8 Q06710 1/20 0.40
CYP1A2 P05177 2/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL8566360 1.00 ALDH1A1 (0.46) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL1092487 0.80 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL1092129 0.80 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL1092131 0.80 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL8567625 0.79 KMT2A (0.41) ALDH1A1NPC1MEN1KMT2ARAB9A
SCHEMBL8567627 0.79 KMT2A (0.41) ALDH1A1NPC1MEN1KMT2ARAB9A
SCHEMBL9000299 0.78 PDE10A (0.54) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL8561899 0.76 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL13351976 0.76 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1
SCHEMBL8561898 0.76 PDE10A (0.49) ALDH1A1NPC1PDE10ALMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed