SCHEMBL8595772

SCHEMBL8595772

CCCCCOc1cnccc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 3/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
RECQL P46063 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
PLA2G4B P0C869 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
NFKB1 P19838 1/20 0.42
MAPK1 P28482 1/20 0.42
NFKB2 Q00653 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL27795167 0.87 SMN1; SMN2 (0.52) LMNASMN1; SMN2MAPTGAANPC1
SCHEMBL28087330 0.84 ALDH1A1 (0.50) LMNAMAPTGAANPC1RAB9A
SCHEMBL8563438 0.84 RAB9A (0.50) LMNASMN1; SMN2MAPTGAANPC1
SCHEMBL9912720 0.84 NPC1 (0.48) LMNASMN1; SMN2MAPTGAANPC1
SCHEMBL30069255 0.84 NPC1 (0.48) LMNASMN1; SMN2MAPTGAANPC1
SCHEMBL1340160 0.78 NPC1 (0.74) LMNASMN1; SMN2MAPTNPC1RAB9A
SCHEMBL8600585 0.78 ESR1 (0.54) LMNAMAPTRAB9ANPSR1ALDH1A1
SCHEMBL8626740 0.78 TXNRD1 (0.39) LMNASMN1; SMN2MAPTGAANPC1
SCHEMBL1123538 0.77 NPC1 (0.72) LMNASMN1; SMN2MAPTNPC1RAB9A
SCHEMBL8581954 0.77 NPC1 (0.72) LMNASMN1; SMN2MAPTNPC1RAB9A

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