SCHEMBL2131223

SCHEMBL2131223

O=C(Cc1cc([C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)ccc1Cl)NNC(=O)c1ccc(-c2ccccc2)o1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 9/20 0.38
▸ PTPN2 P17706 6/20 0.38
▸ TACR2 P21452 1/20 0.37
▸ BCHE P06276 1/20 0.36
▸ CDC25B P30305 7/20 0.36
▸ PTPN6 P29350 5/20 0.36
▸ PTPN11 Q06124 5/20 0.36
▸ SLC5A2 P31639 2/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ NT5E P21589 1/20 0.35
▸ CDC25A P30304 1/20 0.35
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL2129610 0.84 NT5E (0.42) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL2130169 0.83 BCHE (0.43) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL2133682 0.82 PTPN1 (0.43) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL2131750 0.82 BCHE (0.41) PTPN1PTPN2TACR2BCHECDC25B
Hydrochloric Acid SCHEMBL9984358 0.79 PTPN1 (0.41) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL9984091 0.79 SLC5A2 (0.45) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL2130715 0.78 PTPN1 (0.39) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL20643059 0.78 PTPN1 (0.43) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL2131297 0.78 PTPN1 (0.43) PTPN1PTPN2TACR2BCHECDC25B
SCHEMBL9986263 0.78 PTPN1 (0.43) PTPN1PTPN2TACR2BCHECDC25B

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-8541380-B2 C-aryl glucoside SGLT2 inhibitors and pharmaceutical compositions comprising same GREEN CROSS CORPORATION (KR) 2013-09-24 — — US disclosed
US-20120101051-A1 NOVEL C-ARYL GLUCOSIDE SGLT2 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME GREEN CROSS CORPORATION (KR) 2012-04-26 — — US 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 (1 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-20120101051-A1 NOVEL C-ARYL GLUCOSIDE SGLT2 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME SLC5A2, SLC5A1, SLC2A2 PTPN1 197/4885PTPN2 164/4885TACR2 1952/4885

“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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