SCHEMBL7375563

SCHEMBL7375563

CCCc1c(O)ccc2c(=O)cc(-c3ccc(F)cc3)oc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 8/20 0.52
CYP1A1 P04798 4/20 0.52
CYP1A2 P05177 3/20 0.52
CYP1B1 Q16678 3/20 0.52
XDH P47989 1/20 0.52
MAOB P27338 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
TP53 P04637 2/20 0.49
CYP3A4 P08684 2/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
ALOX15 P16050 2/20 0.49
MAPK1 P28482 2/20 0.49
HSD17B10 Q99714 2/20 0.49
BRD4 O60885 1/20 0.49
MEN1 O00255 1/20 0.49
IKBKB O14920 1/20 0.49
CYP19A1 P11511 1/20 0.49
MAOA P21397 1/20 0.49

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
SCHEMBL7375040 0.90 TERT (0.65) TERTCYP1A1CYP1A2CYP1B1MAOB
SCHEMBL7380070 0.88 HPGD (0.65) TERTCYP1A1CYP1A2CYP1B1XDH
SCHEMBL7374824 0.88 TERT (0.65) TERTKDM4EALDH1A1CYP3A4MAPT
SCHEMBL7378981 0.85 TERT (0.52) TERTCYP1A2MAOBKDM4EALDH1A1
SCHEMBL7371005 0.85 CYP1A2 (0.52) TERTCYP1A1CYP1A2CYP1B1MAOB
SCHEMBL7371816 0.84 CSNK2A2 (0.59) TERTMAOBKDM4EALDH1A1TP53
SCHEMBL7371867 0.84 TERT (0.64) TERTCYP1A1CYP1A2CYP1B1MAOB
SCHEMBL7380087 0.82 CSNK2A2 (0.67) TERTKDM4EALDH1A1CYP3A4MAPT
SCHEMBL3181663 0.82 PDE5A (0.59) TERTCYP1A1CYP1A2CYP1B1XDH
SCHEMBL7378867 0.82 CYP3A4 (0.67) TERTCYP1A1CYP1A2CYP1B1MAOB

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