SCHEMBL20139476

SCHEMBL20139476

CCc1cc(OC(F)(F)F)c(Br)cc1Cc1ccc2c(c1)CC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 10/20 0.43
SLC5A2 P31639 10/20 0.43
MBOAT4 Q96T53 1/20 0.34
CETP P11597 1/20 0.33
EPHX2 P34913 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
DDR1 Q08345 1/20 0.31
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 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
SCHEMBL20140138 0.86 SLC5A1 (0.42) SLC5A1SLC5A2MBOAT4CETP
SCHEMBL20140209 0.85 SLC5A1 (0.45) SLC5A1SLC5A2CETP
SCHEMBL20141555 0.79 HTR2A (0.44) SLC5A1SLC5A2
SCHEMBL20139430 0.74 EPHX2 (0.33) EPHX2TRPV1CYP1A2CYP2C19
SCHEMBL20154869 0.74 SLC5A2 (0.53) SLC5A1SLC5A2
SCHEMBL20140030 0.73 SLC5A2 (0.80) SLC5A1SLC5A2
SCHEMBL16682942 0.72 SNCA (0.47) SLC5A1SLC5A2CETPCYP1A2MAPT
SCHEMBL20140227 0.69 SLC5A1 (0.53) SLC5A1SLC5A2CETPMAPT
SCHEMBL31285025 0.68 HTR2A (0.47)
SCHEMBL13073515 0.68 MBOAT4 (0.44) MBOAT4SIGMAR1CYP1A2MAPTCYP2C9

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 SLC5A1 2/4885SLC5A2 1/4885MBOAT4 351/4885

“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.