SCHEMBL8563097

SCHEMBL8563097

Nc1c(/C=C/Cl)nc2ccccc2c1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 4/20 0.40
GLA P06280 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
HPGD P15428 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CHRM2 P08172 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CHRM1 P11229 1/20 0.40
NQO2 P16083 1/20 0.40
MAOA P21397 1/20 0.40
DRD1 P21728 1/20 0.40
ACHE P22303 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1A P35348 1/20 0.40
OPRM1 P35372 1/20 0.40

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
SCHEMBL8563099 1.00 ALDH1A1 (0.40) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8560906 0.86 TAAR1 (0.46) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8564067 0.80 EGFR (0.39) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8564063 0.80 EGFR (0.39) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8567126 0.79 MAPT (0.39) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8567128 0.79 MAPT (0.39) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8564301 0.79 KDM4E (0.47) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8561932 0.77 KDM4E (0.46) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8567364 0.77 KDM4E (0.40) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL8567366 0.77 KDM4E (0.40) ALDH1A1KDM4EGLASMN1; SMN2TDP1

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