SCHEMBL590545

SCHEMBL590545

CC(=O)c1ccc(OCc2ccccc2)c(Br)c1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.68
▸ TDP1 Q9NUW8 2/20 0.68
▸ L3MBTL1 Q9Y468 2/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68
▸ SMN1; SMN2 Q16637 1/20 0.68
▸ MAOB P27338 2/20 0.52
▸ PTPN1 P18031 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ LRRK2 Q5S007 1/20 0.48
▸ PTGER1 P34995 1/20 0.48
▸ FOLH1 Q04609 1/20 0.48
▸ BRD4 O60885 1/20 0.47
▸ CA9 Q16790 1/20 0.46
▸ FFAR4 Q5NUL3 1/20 0.46
▸ SGMS2 Q8NHU3 1/20 0.46
▸ LIPE Q05469 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MCL1 Q07820 1/20 0.44

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
SCHEMBL17958929 0.86 TDP1 (0.54) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL7289598 0.83 MAPT (0.60) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL27703867 0.82 L3MBTL1 (0.63) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL34466860 0.82 TDP1 (0.56) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL12921043 0.82 TDP1 (0.56) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL701961 0.81 MAPT (1.00) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL29633530 0.81 MAPT (1.00) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL21483694 0.80 L3MBTL1 (0.56) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL7855165 0.79 MAPT (0.71) MAPTTDP1L3MBTL1CYP2C9CYP2C19
SCHEMBL30591972 0.78 PTGDR2 (0.67) MAPTTDP1L3MBTL1CYP2C9CYP2C19

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036901-B1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-01 — — EP disclosed
US-8115017-B2 C-phenyl 1-thioglucitol compound TAISHO PHARMACEUTICAL CO., LTD (JP) 2012-02-14 — — US disclosed
US-7973012-B2 C-phenyl glycitol compound TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-07-05 — — US disclosed
US-20100069460-A1 1-PHENYL 1-THIO-D-GLUCITOL DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2010-03-18 — — US disclosed
US-20100022460-A1 C-PHENYL GLYCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2010-01-28 — — US disclosed
US-20100004465-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-01-07 — — US disclosed
EP-2103607-A1 1-PHENYL 1-THIO-D-GLUCITOL DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2009-09-23 — — EP disclosed
EP-2036901-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2009-03-18 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100022460-A1 C-PHENYL GLYCITOL COMPOUND SLC5A1, SLC5A2, SLC2A1 MAPT 1940/4885TDP1 4824/4885L3MBTL1 1761/4885
US-20100004465-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND SLC5A1, SLC5A2, SLC2A1 MAPT 1989/4885TDP1 3815/4885L3MBTL1 3293/4885
US-20100069460-A1 1-PHENYL 1-THIO-D-GLUCITOL DERIVATIVE SLC5A1, SLC5A2, SLC2A1 MAPT 583/4885TDP1 1126/4885L3MBTL1 1636/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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