SCHEMBL8561983

SCHEMBL8561983

COCCc1ncccc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
LMNA P02545 3/20 0.47
PDE10A Q9Y233 1/20 0.45
NPC1 O15118 6/20 0.45
POLB P06746 1/20 0.44
RAB9A P51151 5/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
RECQL P46063 1/20 0.44
CYP1A2 P05177 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CTSB P07858 1/20 0.41

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
SCHEMBL5499664 0.84 ALDH1A1 (0.50) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL13397400 0.82 LMNA (0.62) ALDH1A1LMNANPC1POLBRAB9A
SCHEMBL6369459 0.82 PDE10A (0.49) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL9591091 0.82 PKM (0.52) ALDH1A1PDE10ANPC1POLBRAB9A
SCHEMBL3769047 0.82 PDE10A (0.51) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL6762893 0.80 LMNA (0.46) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL15709862 0.79 LMNA (0.61) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL27679418 0.79 PDE10A (0.49) ALDH1A1LMNAPDE10ANPC1POLB
SCHEMBL30425516 0.78 PDE10A (0.51) ALDH1A1PDE10ANPC1POLBRAB9A
SCHEMBL9986678 0.78 PDE10A (0.51) ALDH1A1PDE10ANPC1POLBRAB9A

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