SCHEMBL20140176

SCHEMBL20140176

O=Cc1cc(C2(O)O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)c(F)cc1C1CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.33
PTPN2 P17706 5/20 0.33
PTPN11 Q06124 5/20 0.33
NT5E P21589 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
CDC25B P30305 7/20 0.33
PTPN6 P29350 4/20 0.33
TACR2 P21452 2/20 0.32
SSTR1 P30872 1/20 0.32
SSTR2 P30874 1/20 0.32
SSTR4 P31391 1/20 0.32
SSTR3 P32745 1/20 0.32
SSTR5 P35346 1/20 0.32
HTR1A P08908 1/20 0.32
OPRM1 P35372 2/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31

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
SCHEMBL20140011 0.87 NT5E (0.35) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL20139433 0.87 TACR2 (0.37) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL20139455 0.86 TACR2 (0.36) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL2174055 0.79 TACR2 (0.36) PTPN1PTPN2PTPN11NT5ECDC25B
SCHEMBL2174063 0.79 TACR2 (0.36) PTPN1PTPN2PTPN11NT5ECDC25B
SCHEMBL20140033 0.78 TACR2 (0.34) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL2087673 0.75 ERN1 (0.39) PTPN1PTPN2PTPN11NT5ECDC25B
SCHEMBL10193899 0.75 SLC5A1 (0.34) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL3940838 0.75 SLC5A1 (0.34) PTPN1PTPN2PTPN11NT5ETP53
SCHEMBL12407931 0.74 MAOA (0.39) PTPN1PTPN2PTPN11NT5ECDC25B

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-10815210-B2 Benzocyclobutane derivatives useful as dual SGLT1 / SGLT2 modulators JANSSEN PHARMACEUTICA NV (BE) 2020-10-27 US disclosed
WO-2018089449-A1 BENZOCYCLOBUTANE DERIVATIVES USEFUL AS DUAL SGLT1/SGLT2 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-17 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 (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-10815210-B2 Benzocyclobutane derivatives useful as dual SGLT1 / SGLT2 modulators SLC5A2, SLC5A1, SLC2A2 PTPN1 1940/4885PTPN2 1045/4885PTPN11 1809/4885

“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.