SCHEMBL8559919

SCHEMBL8559919

COCCc1c(N)c([N+](=O)[O-])nc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.43
NCF1 P14598 2/20 0.40
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 4/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
LMNA P02545 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
GLA P06280 2/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
NQO2 P16083 1/20 0.36
MAOA P21397 1/20 0.36

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
SCHEMBL8600688 0.82 TLR8 (0.54) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL8564398 0.82 POLB (0.43) POLBNCF1KDM4EALDH1A1HPGD
SCHEMBL8561287 0.81 POLB (0.42) POLBNCF1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8566788 0.80 KDM4E (0.41) POLBKDM4EALDH1A1HPGDGAA
SCHEMBL8559235 0.80 KDM4E (0.41) POLBKDM4EALDH1A1HPGDGAA
SCHEMBL8566973 0.77 POLB (0.43) POLBNCF1KDM4EALDH1A1HPGD
SCHEMBL8601130 0.76 KDM4E (0.38) POLBKDM4EALDH1A1HPGDGAA
SCHEMBL8566398 0.76 POLB (0.38) POLBNCF1KDM4EALDH1A1HPGD
SCHEMBL8566394 0.76 POLB (0.38) POLBNCF1KDM4EALDH1A1HPGD
SCHEMBL8564523 0.76 KDM4E (0.53) POLBKDM4EALDH1A1HPGDGAA

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