SCHEMBL12034236

SCHEMBL12034236

CCCn1ccnc1N=Nc1c(O)n(CC)c(=S)n(CC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.43
▸ POLB P06746 3/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ XDH P47989 1/20 0.35
▸ LMNA P02545 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ HTT P42858 2/20 0.34
▸ PDE4A P27815 5/20 0.33
▸ PDE4B Q07343 5/20 0.33
▸ PDE4C Q08493 5/20 0.33
▸ PDE4D Q08499 5/20 0.33
▸ TNFRSF1A P19438 3/20 0.33
▸ PDE1A P54750 2/20 0.33
▸ PDE1B Q01064 2/20 0.33

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
SCHEMBL12034096 0.74 MAPT (0.51) MAPTPOLBMAPK1ATMTDP1
SCHEMBL13661831 0.72 MAPT (0.45) MAPTPOLBMAPK1ATMTDP1
SCHEMBL14530199 0.69 MAPT (0.46) MAPTPOLBMAPK1ATMTDP1
SCHEMBL13661832 0.68 MAPT (0.39) MAPTPOLBMAPK1ATMTDP1
SCHEMBL12034192 0.68 MAPT (0.44) MAPTPOLBMAPK1ATMTDP1
SCHEMBL12034169 0.68 MAPT (0.47) MAPTPOLBMAPK1ATMTDP1
SCHEMBL13661780 0.65 MAPT (0.47) MAPTPOLBMAPK1ATMTDP1
SCHEMBL14541945 0.65 MAPT (0.65) MAPTPOLBMAPK1ATMTDP1
SCHEMBL12125332 0.65 MAPT (0.42) MAPTPOLBMAPK1ATMTDP1
SCHEMBL12034206 0.65 ALPG (0.37) MAPTPOLBMAPK1ATMTDP1

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
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-20110311752-A1 OPTICAL RECORDING MEDIUM, OPTICAL RECORDING MATERIAL AND METAL COMPLEX COMPOUND MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2011-12-22 — — 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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