SCHEMBL8569559

SCHEMBL8569559

O=[N+]([O-])c1cc(NCc2ccccc2)nc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.59
ALDH1A1 P00352 2/20 0.59
KDM4E B2RXH2 2/20 0.59
HPGD P15428 1/20 0.59
KMT2A Q03164 6/20 0.51
MEN1 O00255 5/20 0.51
EGFR P00533 3/20 0.51
MAPT P10636 4/20 0.51
POLB P06746 3/20 0.51
RAD52 P43351 2/20 0.49
PDE5A O76074 1/20 0.48
LMNA P02545 1/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
CTSB P07858 1/20 0.46
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
ELANE P08246 1/20 0.45
ACHE P22303 1/20 0.45

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
SCHEMBL8598717 0.81 RAB9A (0.47) SMN1; SMN2ALDH1A1KDM4EHPGDKMT2A
SCHEMBL2137910 0.80 MAPT (0.52) SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1
SCHEMBL8600541 0.79 KDM4E (0.51) SMN1; SMN2ALDH1A1KDM4EHPGDKMT2A
SCHEMBL8568794 0.77 HPGD (0.54) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL8561794 0.76 VCAM1 (0.57) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL8567246 0.75 MAPT (0.45) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL8562615 0.75 KMT2A (0.51) SMN1; SMN2ALDH1A1KDM4EHPGDKMT2A
SCHEMBL21796417 0.75 KDM4E (0.68) SMN1; SMN2ALDH1A1KDM4EHPGDKMT2A
SCHEMBL8562721 0.74 KMT2A (0.55) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL5759562 0.73 POLB (0.55) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1

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