SCHEMBL20139367

SCHEMBL20139367

Clc1ccc(Br)cc1Cc1ccc2c(c1)CC2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 8/20 0.48
SLC5A1 P13866 4/20 0.48
CCR5 P51681 3/20 0.35
SLC6A4 P31645 3/20 0.34
PNMT P11086 1/20 0.34
ASIC3 Q9UHC3 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HTR2A P28223 2/20 0.34
KCNH2 Q12809 2/20 0.34
MPO P05164 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL20139399 0.88 SLC5A2 (0.42) SLC5A2SLC5A1CCR5ALDH1A1
SCHEMBL20140005 0.81 METAP1 (0.38) SLC5A2SLC5A1CCR5
SCHEMBL20139385 0.81 SLC5A1 (0.48) SLC5A2SLC5A1PNMTASIC3MPO
SCHEMBL30137005 0.80 SLC5A2 (0.42) SLC5A2SLC5A1
SCHEMBL10040915 0.80 SLC5A2 (0.42) SLC5A2SLC5A1
SCHEMBL20140006 0.78 IL4I1 (0.36) SLC5A2SLC5A1CCR5
SCHEMBL12782162 0.78 CCR5 (0.47) CCR5SLC6A4HTR2AKCNH2
SCHEMBL20139378 0.77 CCR5 (0.36) SLC5A2SLC5A1CCR5PNMTASIC3
SCHEMBL20139469 0.77 SLC5A1 (0.51) SLC5A2SLC5A1ALDH1A1
SCHEMBL20139435 0.77 SLC5A2 (0.51) SLC5A2SLC5A1MPOALDH1A1HPGD

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 SLC5A2 1/4885SLC5A1 2/4885CCR5 1266/4885

“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.