SCHEMBL7371872

SCHEMBL7371872

CCCc1c(O)ccc2c(=O)cc(-c3ccc(OC)c([N+](=O)[O-])c3)oc12

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TERT O14746 4/20 0.54
CSNK2A2 P19784 12/20 0.51
CSNK2B P67870 12/20 0.51
CSNK2A1 P68400 12/20 0.51
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
CYP1B1 Q16678 1/20 0.46

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
SCHEMBL7380154 0.92 TERT (0.54) TERTCSNK2A2CSNK2BCSNK2A1CYP3A4
SCHEMBL7380352 0.90 CSNK2A2 (0.62) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7380087 0.86 CSNK2A2 (0.67) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7374824 0.80 TERT (0.65) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7374866 0.79 ALDH1A1 (0.53) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7381488 0.78 ALDH1A1 (0.49) ALDH1A1
SCHEMBL7378981 0.78 TERT (0.52) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7375040 0.78 TERT (0.65) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7376811 0.78 CYP1A1 (0.59) TERTCSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL7379107 0.78 CSNK2A2 (0.53) TERTCSNK2A2CSNK2BCSNK2A1

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-1115718-A1 HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-18 EP disclosed
WO-2000017184-A1 HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-30 WO disclosed