SCHEMBL8565828

SCHEMBL8565828

C=C(c1ccccc1)c1nccc(N)c1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.38
HTT P42858 4/20 0.37
HSD17B10 Q99714 1/20 0.37
NPY1R P25929 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 2/20 0.35
BCL6 P41182 1/20 0.35
BCOR Q6W2J9 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ASPH Q12797 1/20 0.34
KDM8 Q8N371 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MITF O75030 1/20 0.34

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
SCHEMBL8565282 0.79 KDM4E (0.42) MAPTLMNASMN1; SMN2MAPK1HTT
SCHEMBL8570524 0.77 MAPT (0.42) MAPTLMNASMN1; SMN2MAPK1HTT
SCHEMBL8562662 0.75 KDM4E (0.39) MAPTLMNASMN1; SMN2HTTMEN1
SCHEMBL8567354 0.75 HTT (0.40) MAPTLMNASMN1; SMN2HTTMEN1
SCHEMBL8566546 0.75 MEN1 (0.48) MAPTLMNAMEN1KMT2APOLB
SCHEMBL8561746 0.74 PDE3B (0.40) MAPTLMNASMN1; SMN2MAPK1NPY1R
SCHEMBL8560902 0.72 ADORA3 (0.38) MAPTLMNASMN1; SMN2MAPK1HTT
SCHEMBL8565008 0.72 HPGD (0.54) MAPTMAPK1HTTKMT2AADORA2A
SCHEMBL8564059 0.72 RAB9A (0.49) MAPTLMNAKMT2APOLBADORA2A
SCHEMBL8568617 0.71 MAPK1 (0.38) MAPTLMNASMN1; SMN2MAPK1HTT

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