SCHEMBL8599262

SCHEMBL8599262

COCC=Cc1ccnc([N+](=O)[O-])c1N

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 3/20 0.30
MAPT P10636 3/20 0.30
HTT P42858 3/20 0.30
POLB P06746 2/20 0.30
ESR2 Q92731 1/20 0.30
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL8599258 1.00 KMT2A (0.33) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8568096 0.82 KMT2A (0.38) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8568101 0.82 KMT2A (0.38) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8567625 0.80 KMT2A (0.41) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8567627 0.80 KMT2A (0.41) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8565614 0.78 MAPT (0.33) KMT2AMEN1ALDH1A1MAPTRAB9A
SCHEMBL8565616 0.78 MAPT (0.33) KMT2AMEN1ALDH1A1MAPTRAB9A
SCHEMBL8561307 0.75 MEN1 (0.35) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8561311 0.75 MEN1 (0.35) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8563923 0.75 ALDH1A1 (0.33) ALDH1A1MAPT

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