SCHEMBL8562632

SCHEMBL8562632

Nc1c([N+](=O)[O-])nc2ccccc2c1C(=O)NCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.47
RECQL P46063 1/20 0.47
RAB9A P51151 1/20 0.47
MCL1 Q07820 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
TACR3 P29371 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
GAA P10253 1/20 0.45
PLAU P00749 1/20 0.44
USP7 Q93009 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL8598657 0.85 HPGD (0.50) L3MBTL1KDM4EMEN1KMT2APOLB
SCHEMBL8568442 0.83 KDM4E (0.52) L3MBTL1KDM4EMEN1NPC1KMT2A
SCHEMBL8595761 0.83 NAAA (0.45) L3MBTL1KDM4EMEN1NPC1KMT2A
SCHEMBL8570921 0.82 NPC1 (0.40) KDM4EMEN1NPC1KMT2APOLB
SCHEMBL8567241 0.82 PDE10A (0.46) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL8563112 0.80 HSD17B10 (0.43) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL8563863 0.80 ALDH1A1 (0.51) L3MBTL1KDM4EMEN1KMT2APOLB
SCHEMBL8567636 0.79 HSD17B10 (0.56) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL8563024 0.79 KMT2A (0.57) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL8560819 0.78 HPGD (0.53) L3MBTL1KDM4ETACR3GAAPLAU

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