SCHEMBL8599362

SCHEMBL8599362

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
PKM P14618 2/20 0.41
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
ATG4B Q9Y4P1 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
ALOX15 P16050 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA1 P00915 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL8599108 0.80 SMN1; SMN2 (0.43) SMN1; SMN2HPGDKMT2AMEN1PKM
SCHEMBL8565008 0.79 HPGD (0.54) HPGDKMT2AMAPTALDH1A1RAB9A
SCHEMBL8601107 0.78 NAAA (0.45) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL8597405 0.77 KDM4E (0.38) SMN1; SMN2HPGDKMT2AMEN1MAPT
SCHEMBL8597731 0.76 MAPT (0.47) SMN1; SMN2HPGDKMT2AMEN1PKM
SCHEMBL8599698 0.76 KMT2A (0.43) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL8598112 0.74 SMN1; SMN2 (0.43) SMN1; SMN2HPGDKMT2AMEN1PKM
SCHEMBL8562662 0.74 KDM4E (0.39) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL8565282 0.74 KDM4E (0.42) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL8561746 0.73 PDE3B (0.40) SMN1; SMN2KMT2AMEN1MAPTALDH1A1

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