SCHEMBL12034294

SCHEMBL12034294

CCc1csc(N=Nc2c(O)c3ccccc3oc2=O)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.45
▸ NQO1 P15559 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ PKM P14618 1/20 0.42
▸ VKORC1 Q9BQB6 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ABCB11 O95342 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KMT2A Q03164 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
SCHEMBL12052696 0.88 MAPT (0.45) MAPTATMRXFP1KDM4ENQO1
SCHEMBL13661850 0.81 ALDH1A1 (0.54) MAPTATMRXFP1KDM4ENQO1
SCHEMBL12034211 0.79 MAPT (0.48) MAPTATMRXFP1KDM4ENQO1
SCHEMBL12034302 0.78 MAPT (0.52) MAPTKDM4ECYP2C9PKMALDH1A1
SCHEMBL13830204 0.77 ALDH1A1 (0.49) MAPTRXFP1KDM4EALDH1A1MEN1
SCHEMBL11766670 0.74 MAPT (0.59) MAPTATMRXFP1KDM4ENQO1
SCHEMBL11766676 0.74 MAPT (0.59) MAPTATMRXFP1KDM4ENQO1
SCHEMBL12034291 0.72 MAPT (0.48) MAPTATMRXFP1KDM4ENQO1
SCHEMBL12034296 0.70 MAPT (0.41) MAPTRXFP1KDM4ECYP2C9ALDH1A1
SCHEMBL12034292 0.70 MAPT (0.48) MAPTATMRXFP1KDM4ENQO1

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