SCHEMBL589028

SCHEMBL589028

C=CCNC(=O)NC(C)(C)CO

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 1/20 0.39
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 2/20 0.37
FAAH O00519 1/20 0.37
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 2/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 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
SCHEMBL12669780 0.82 SMN1; SMN2 (0.43) SMN1; SMN2TSHRMAPTNPSR1KMT2A
SCHEMBL2172164 0.80 SMN1; SMN2 (0.42) SMN1; SMN2TSHRMAPTNPSR1KMT2A
SCHEMBL27077599 0.76 POLB (0.47) SMN1; SMN2POLBEPHX1ALDH1A1RAB9A
SCHEMBL618600 0.75 EPHX1 (0.44) SMN1; SMN2POLBKMT2AEPHX1ALDH1A1
SCHEMBL5138597 0.74 SMN1; SMN2 (0.52) SMN1; SMN2TSHRMAPTNPSR1KMT2A
SCHEMBL252121 0.73 TSHR (0.56) SMN1; SMN2TSHRMAPTNPSR1KMT2A
SCHEMBL8060600 0.73 TSHR (0.56) SMN1; SMN2TSHRMAPTNPSR1KMT2A
SCHEMBL9141611 0.73 ALDH1A1 (0.38) SMN1; SMN2TSHRMAPTNPSR1KMT2A
Hydrochloric Acid SCHEMBL5964776 0.73 ALDH1A1 (0.38) TSHRKMT2AALDH1A1HTTMEN1
SCHEMBL275055 0.72 TSHR (0.42) SMN1; SMN2TSHRMAPTNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2076503-B1 C-PHENYL GLYCITOL COMPOUND FOR THE TREATMENT OF DIABETES TAISHO PHARMACEUTICAL CO LTD (JP) 2013-07-17 EP disclosed
EP-2036901-B1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-01 EP disclosed
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-8115017-B2 C-phenyl 1-thioglucitol compound TAISHO PHARMACEUTICAL CO., LTD (JP) 2012-02-14 US 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-7973012-B2 C-phenyl glycitol compound TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-07-05 US disclosed
US-20100022460-A1 C-PHENYL GLYCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2010-01-28 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
US-20100004465-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-01-07 US disclosed
US-20100004465-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-01-07 US disclosed
EP-2036901-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2009-03-18 EP disclosed
EP-2036901-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2009-03-18 EP disclosed
WO-2007136116-A2 C-PHENYL GLYCITOL COMPOUND FOR THE TREATMENT OF DIABETES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-11-29 WO 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 (2 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 SMN1; SMN2 4544/4885TSHR 2437/4885MAPT 1940/4885
US-20100004465-A1 C-PHENYL 1-THIOGLUCITOL COMPOUND SLC5A1, SLC5A2, SLC2A1 SMN1; SMN2 4505/4885TSHR 754/4885MAPT 1989/4885

“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.