SCHEMBL8569473

SCHEMBL8569473

O=[N+]([O-])c1nc2ccccc2c(F)c1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
POLB P06746 4/20 0.38
MAPT P10636 7/20 0.37
KMT2A Q03164 7/20 0.37
MEN1 O00255 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 2/20 0.37
GLA P06280 2/20 0.37
HTT P42858 2/20 0.37
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PRKAA2 P54646 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
MCL1 Q07820 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
GUSB P08236 2/20 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
SCHEMBL8561589 0.85 KDM1A (0.35) POLBMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8561732 0.77 PRKAA2 (0.43) BCHEACHEPOLBMAPTKMT2A
SCHEMBL8562365 0.73 ACHE (0.40) BCHEACHEMAPTKMT2AMEN1
SCHEMBL8211008 0.71 KMT2A (0.46) POLBMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8563673 0.69 CYP3A4 (0.36) BCHEACHEPOLBMAPTKMT2A
SCHEMBL28528656 0.68 CYP3A4 (0.48) POLBMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL4936203 0.68 PRKAA2 (0.51) BCHEACHEPOLBSMN1; SMN2MAPK1
SCHEMBL11667039 0.68 MAPT (0.48) MAPTKMT2AMEN1SMN1; SMN2MAPK1
SCHEMBL21632212 0.67 MAOA (0.53) POLBMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8564523 0.67 KDM4E (0.53) BCHEACHEPOLBMAPTKMT2A

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 4 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
CN-1138033-A Process for produducing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1996-12-18 CN disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed