SCHEMBL8601055

SCHEMBL8601055

CCCCCSc1cc(N)cnc1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
SCN9A Q15858 2/20 0.36
SCN5A Q14524 1/20 0.36
HASPIN Q8TF76 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TLR8 Q9NR97 1/20 0.35
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CNR2 P34972 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL8596775 0.78 RAB9A (0.35) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL8602297 0.76 L3MBTL1 (0.40) MAPTL3MBTL1KDM4EMEN1GAA
SCHEMBL8596095 0.76 GPR84 (0.41) MAPTSCN9ASCN5AHASPINMEN1
SCHEMBL8600520 0.76 L3MBTL1 (0.43) MAPTL3MBTL1SCN9ASCN5AHASPIN
SCHEMBL8600733 0.75 PTGS2 (0.42) MAPTHASPINMEN1GAAHTT
SCHEMBL8596671 0.75 SMN1; SMN2 (0.41) MAPTL3MBTL1MEN1GAATSHR
SCHEMBL8599737 0.73 L3MBTL1 (0.49) MAPTL3MBTL1GAATLR8SMN1; SMN2
SCHEMBL8561788 0.73 ALDH1A1 (0.47) MAPTL3MBTL1SCN9AMEN1KMT2A
SCHEMBL8596090 0.72 TXNRD1 (0.41) MAPTL3MBTL1MEN1GAAHTT
SCHEMBL8601240 0.72 RECQL (0.40) MAPTL3MBTL1KDM4EMEN1TSHR

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