SCHEMBL11725136

SCHEMBL11725136

O=C(NO)c1cncc([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ GAA P10253 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ POLB P06746 1/20 0.46
▸ CACNA1B Q00975 1/20 0.46
▸ APBA1 Q02410 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 1/20 0.43
▸ HDAC1 Q13547 2/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ PTGS1 P23219 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL11719928 0.88 KMT2A (0.51) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL11718691 0.85 GAA (0.50) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL11718597 0.82 GAA (0.48) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL11724159 0.82 THRB (0.47) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL31226590 0.81 XDH (0.51) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL31226521 0.81 GAA (0.50) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL1607866 0.80 TP53 (0.55) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL940807 0.80 TP53 (0.55) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL11725373 0.80 MEN1 (0.53) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL11723199 0.80 MAPT (0.50) MAPTKMT2AMEN1GAASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4053608-A 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED SANKYO COMPANY LIMITED (JA) 1977-10-11 — — US claimed
US-4053608-A 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED SANKYO COMPANY LIMITED (JA) 1977-10-11 — — US disclosed
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