SCHEMBL8567191

SCHEMBL8567191

Nc1nccc(C(=O)O)c1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.50
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPT P10636 5/20 0.43
KDM4E B2RXH2 4/20 0.43
HTT P42858 4/20 0.43
MITF O75030 1/20 0.43
ASPH Q12797 2/20 0.43
KDM8 Q8N371 2/20 0.43
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
KDM6B O15054 1/20 0.42
KDM4A O75164 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
KDM4C Q9H3R0 1/20 0.42

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
SCHEMBL8563215 0.88 KMT2A (0.42) NAPRTALDH1A1TDP1MAPTKDM4E
SCHEMBL8561844 0.86 MAPT (0.41) NAPRTALDH1A1MAPTKDM4EHTT
SCHEMBL8562600 0.81 LMNA (0.47) ALDH1A1MAPTKDM4EHTTMITF
SCHEMBL31693360 0.80 ASPH (0.55) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL27888702 0.80 KDM4E (0.43) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL15758083 0.80 ASPH (0.55) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL8570524 0.80 MAPT (0.42) NAPRTCYP3A4MAPTKDM4EHTT
SCHEMBL2747912 0.79 TSHR (0.45) ALDH1A1TDP1MAPTKDM4EASPH
SCHEMBL31092297 0.79 SMN1; SMN2 (0.50) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL2747917 0.79 TSHR (0.45) ALDH1A1TDP1MAPTKDM4EASPH

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