SCHEMBL9443874

SCHEMBL9443874

O=C(O)c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-].O=C(O)c1c[nH]c(=S)[nH]c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM3B Q7LBC6 1/20 0.60
▸ KMT2A Q03164 8/20 0.35
▸ MEN1 O00255 7/20 0.35
▸ POLB P06746 2/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ DNA2 P51530 1/20 0.34
▸ CASP6 P55212 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ GFER P55789 1/20 0.33
▸ CACNA1B Q00975 1/20 0.33
▸ APBA1 Q02410 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GALK1 P51570 3/20 0.32
▸ GAA P10253 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1088411 0.81 JAK2 (0.50) KMT2AMEN1POLBJAK2THRB
SCHEMBL5069969 0.79 JAK2 (0.48) KMT2AMEN1POLBJAK2THRB
SCHEMBL28157987 0.79 JAK2 (0.48) KMT2AMEN1POLBJAK2THRB
Potassium Ion SCHEMBL5069972 0.79 JAK2 (0.48) KMT2AMEN1POLBJAK2THRB
SCHEMBL28883832 0.79 JAK2 (0.48) KMT2AMEN1POLBJAK2THRB
SCHEMBL28253644 0.79 JAK2 (0.48) KMT2AMEN1POLBJAK2THRB
Water SCHEMBL28149624 0.78 JAK2 (0.47) KMT2AMEN1POLBJAK2THRB
SCHEMBL2491527 0.78 KDM3B (1.00) KDM3BKMT2AALDH1A1MAPTGFER
Pyrimidine SCHEMBL28357829 0.73 MEN1 (0.46) KMT2AMEN1POLBJAK2THRB
SCHEMBL127493 0.67 KDM3B (0.64) KDM3BALDH1A1MAPTGAAKDM4E

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-0504279-A4 FERMENTATION PROCESS FOR THE PRODUCTION OF PYRIMIDINE DEOXYRIBONUCLEOSIDES — 1993-02-17 — — EP disclosed
EP-0504279-A1 FERMENTATION PROCESS FOR THE PRODUCTION OF PYRIMIDINE DEOXYRIBONUCLEOSIDES. CHEMGEN CORP (US) 1992-09-23 — — EP disclosed
WO-1991009130-A1 FERMENTATION PROCESS FOR THE PRODUCTION OF PYRIMIDINE DEOXYRIBONUCLEOSIDES CHEMGEN CORPORATION (US) 1991-06-27 — — WO disclosed
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