SCHEMBL20139425

SCHEMBL20139425

C=CCOc1ccc(Br)cc1Cc1ccc2c(c1)CC2

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
ADRA2A P08913 2/20 0.40
ADRA2B P18089 2/20 0.40
ADRA2C P18825 2/20 0.40
CCR5 P51681 8/20 0.37
SLC5A1 P13866 1/20 0.35
SLC5A2 P31639 1/20 0.35
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
CETP P11597 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL20139469 0.80 SLC5A1 (0.51) MEN1HTTKMT2AALDH1A1SLC5A1
SCHEMBL20139395 0.77 HTR2A (0.39) HPGDADRA2AADRA2BADRA2CSLC5A1
SCHEMBL7812842 0.74 KMT2A (0.62) MEN1HTTKMT2AMAPK1ALDH1A1
SCHEMBL7812819 0.73 MAPK1 (0.66) MEN1HTTKMT2AMAPK1ALDH1A1
SCHEMBL20139367 0.72 SLC5A2 (0.48) ALDH1A1HPGDCCR5SLC5A1SLC5A2
SCHEMBL20139385 0.72 SLC5A1 (0.48) ALDH1A1SLC5A1SLC5A2CETP
SCHEMBL20139699 0.72 HPGD (0.44) MEN1HTTKMT2AMAPK1ALDH1A1
SCHEMBL2187712 0.71 MAPK1 (0.59) MEN1HTTKMT2AMAPK1ALDH1A1
SCHEMBL2322279 0.69 HPGD (0.59) MEN1HTTKMT2AMAPK1ALDH1A1
SCHEMBL14392489 0.69 HPGD (0.59) MEN1HTTKMT2AMAPK1ALDH1A1

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 MEN1 4069/4885HTT 3262/4885KMT2A 1219/4885

“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.