SCHEMBL8567582

SCHEMBL8567582

Nc1c([N+](=O)[O-])nc2ccccc2c1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGMT P16455 2/20 0.48
PIN1 Q13526 2/20 0.45
ELANE P08246 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.41
PDE5A O76074 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
ATM Q13315 1/20 0.41
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR1 P21554 1/20 0.40
ACHE P22303 1/20 0.40
CNR2 P34972 1/20 0.40
ALDH1A1 P00352 1/20 0.39
DCPS Q96C86 1/20 0.39

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
SCHEMBL8561287 0.82 POLB (0.42) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL8566311 0.82 MGMT (0.61) MGMTPIN1ELANELMNAMAPT
SCHEMBL8597821 0.81 LMNA (0.43) KMT2AMEN1LMNAATMMAPT
SCHEMBL8563611 0.80 PIN1 (0.54) MGMTPIN1ELANEKMT2AMEN1
SCHEMBL8559235 0.78 KDM4E (0.41) ELANEKMT2AMEN1LMNANPC1
SCHEMBL8563863 0.78 ALDH1A1 (0.51) MGMTKMT2AMEN1LMNARAB9A
SCHEMBL8922116 0.78 MGMT (0.39) MGMTPIN1ELANEKMT2AMEN1
SCHEMBL8564625 0.77 MAPT (0.38) KMT2AMEN1LMNARAB9AMAPT
SCHEMBL8565124 0.77 KDM4E (0.38) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL8564523 0.77 KDM4E (0.53) ELANEKMT2AMEN1LMNARAB9A

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