SCHEMBL20139411

SCHEMBL20139411

COc1cc(OCc2ccccc2)c(Br)cc1Cc1ccc2c(c1)CC2

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.47
SLC5A1 P13866 4/20 0.46
SLC5A2 P31639 4/20 0.46
PTPN1 P18031 2/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
REV1 Q9UBZ9 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
ABCB1 P08183 1/20 0.40

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
SCHEMBL20139491 0.87 HTR2A (0.45) CHRNA7SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL20141555 0.86 HTR2A (0.44) CHRNA7SLC5A1SLC5A2PTPN1HTR2A
SCHEMBL20140091 0.85 SLC5A1 (0.42) CHRNA7SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL20139495 0.85 HTR2A (0.42) CHRNA7SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL20139395 0.84 HTR2A (0.39) CHRNA7SLC5A1SLC5A2PTPN1HTR2A
SCHEMBL20140059 0.84 HTR2A (0.43) CHRNA7PTPN1HTR2AHTR2CMEN1
SCHEMBL21557886 0.83 SLC5A1 (0.47) CHRNA7SLC5A1SLC5A2PTPN1HTR2A
SCHEMBL20139432 0.82 HTR2A (0.45) CHRNA7SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL20139443 0.81 RAB9A (0.48) CHRNA7PTPN1HTR2AHTR2CHRH3
SCHEMBL23700112 0.81 MAOB (0.49) SLC5A1SLC5A2PTPN1HTR2AHTR2C

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 CHRNA7 3628/4885SLC5A1 2/4885SLC5A2 1/4885

“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.