SCHEMBL20140089

SCHEMBL20140089

COc1cc(OC)c(C(O)c2ccc3c(c2)C2(C3)OCCO2)cc1Br

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.38
TOP2B Q02880 1/20 0.38
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
MTNR1A P48039 1/20 0.31
MTNR1B P49286 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
SCHEMBL20140114 0.92 TOP2A (0.37) TOP2ATOP2BALDH1A1HTTMTNR1A
SCHEMBL20140163 0.90 TOP2A (0.36) TOP2ATOP2BALDH1A1HTT
SCHEMBL20139409 0.84 TOP2A (0.36) TOP2ATOP2BALDH1A1HTT
SCHEMBL20140012 0.83 TOP2A (0.35) TOP2ATOP2B
SCHEMBL20139635 0.79 ALDH1A1 (0.36) TOP2ATOP2BALDH1A1HTT
SCHEMBL20140360 0.73
SCHEMBL20139974 0.69 TOP2A (0.36) TOP2ATOP2BALDH1A1
SCHEMBL20139978 0.69 TOP2A (0.41) TOP2ATOP2BALDH1A1HTTMTNR1A
SCHEMBL20140293 0.68 TOP2A (0.36) TOP2ATOP2BALDH1A1HTT
SCHEMBL20139480 0.66 CHRNA7 (0.44) TOP2ATOP2B

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 TOP2A 2707/4885TOP2B 2772/4885ALDH1A1 2392/4885

“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.