SCHEMBL13663743

SCHEMBL13663743

CCOOCc1csc(N=Nc2c(O)c3ccccc3n(C)c2=O)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.45
▸ SMN1; SMN2 Q16637 6/20 0.45
▸ GAA P10253 4/20 0.45
▸ MGAM O43451 3/20 0.45
▸ SI P14410 3/20 0.45
▸ MGAM2 Q2M2H8 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 6/20 0.42
▸ RXFP1 Q9HBX9 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ PRNP P04156 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ ALOX15 P16050 1/20 0.36

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
SCHEMBL13830204 0.88 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2GAAMGAMSI
SCHEMBL13661853 0.81 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2GAAMGAMSI
SCHEMBL12052697 0.80 ALDH1A1 (0.47) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL12052696 0.80 MAPT (0.45) ALDH1A1GAAHPGDMAPTKDM4E
SCHEMBL12052690 0.77 L3MBTL1 (0.38) ALDH1A1SMN1; SMN2GAAMGAMSI
SCHEMBL12052691 0.74 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAHPGDMAPT
SCHEMBL30440624 0.67 KMT2A (0.57) ALDH1A1SMN1; SMN2GAAHPGDMAPT
SCHEMBL12034303 0.67 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2HPGDMAPTKDM4E
SCHEMBL12034302 0.66 MAPT (0.52) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL12034294 0.66 MAPT (0.49) ALDH1A1MAPTKDM4ERXFP1HSD17B10

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-8309196-B2 Optical recording medium, optical recording material and metal complex compound MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2012-11-13 — — US disclosed
US-20090263611-A1 OPTICAL RECORDING MEDIUM, OPTICAL RECORDING MATERIAL AND METAL COMPLEX COMPOUND MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2009-10-22 — — US disclosed
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