SCHEMBL20139635

SCHEMBL20139635

COc1ccc(Br)cc1C(O)c1ccc2c(c1)CC21OCCO1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
TOP2A P11388 1/20 0.33
TOP2B Q02880 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
LMNA P02545 1/20 0.31
ACHE P22303 1/20 0.31
KMT2A Q03164 1/20 0.30
HPGD P15428 1/20 0.30

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 0.87 TOP2A (0.37) ALDH1A1HTTTOP2ATOP2B
SCHEMBL20140180 0.83 SMN1; SMN2 (0.33)
SCHEMBL20139409 0.83 TOP2A (0.36) ALDH1A1HTTTOP2ATOP2B
SCHEMBL20140012 0.82 TOP2A (0.35) TOP2ATOP2B
SCHEMBL20140072 0.80 KMT2A (0.40) ALDH1A1TOP2ATOP2BLMNAKMT2A
SCHEMBL20140089 0.79 TOP2A (0.38) ALDH1A1HTTTOP2ATOP2B
SCHEMBL5752891 0.75 HPGD (0.43) TOP2ATOP2BLMNAKMT2AHPGD
SCHEMBL20140360 0.74
SCHEMBL20140163 0.74 TOP2A (0.36) ALDH1A1HTTTOP2ATOP2B
SCHEMBL22567805 0.73 TDP2 (0.40) HTTSLC6A4LMNA

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 ALDH1A1 2392/4885HTT 3262/4885TOP2A 2707/4885

“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.