SCHEMBL10936600

SCHEMBL10936600

O=C(OCCOC(=O)c1cccnc1)c1ccncc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.68
LMNA P02545 4/20 0.64
KMT2A Q03164 4/20 0.60
TDP1 Q9NUW8 2/20 0.60
ALDH1A1 P00352 4/20 0.57
GAA P10253 1/20 0.57
MAPT P10636 3/20 0.56
MEN1 O00255 2/20 0.56
HPGD P15428 1/20 0.56
KDM4E B2RXH2 1/20 0.56
USP2 O75604 2/20 0.55
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL30556174 0.93 L3MBTL1 (0.76) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL25009812 0.93 L3MBTL1 (0.76) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL5363082 0.92 LMNA (0.71) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL21243071 0.86 LMNA (0.82) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL25009811 0.86 L3MBTL1 (0.82) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL15953935 0.86 L3MBTL1 (0.59) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL5363062 0.85 L3MBTL1 (0.70) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL5353549 0.85 L3MBTL1 (0.70) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL9717090 0.85 L3MBTL1 (0.69) L3MBTL1LMNAKMT2ATDP1ALDH1A1
SCHEMBL27430724 0.84 ALDH1A1 (0.62) L3MBTL1LMNAKMT2ATDP1ALDH1A1

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
EP-0148883-A1 ALLOPURINOL PRODRUGS. GEA AS (DK) 1985-07-24 EP disclosed
WO-1985000368-A1 ALLOPURINOL PRODRUGS A/S GEA (DK) 1985-01-31 WO disclosed