SCHEMBL6486012

SCHEMBL6486012

O=S(=O)(Nc1ccc2c(OCc3ccc(-c4ccc(Cl)c(Cl)c4)cc3Cl)cccc2c1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.41
CYP2D6 P10635 3/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC6A3 Q01959 3/20 0.41
KCNH2 Q12809 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
EPHX2 P34913 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37

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
SCHEMBL6483514 0.94 CYP3A4 (0.40) CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL6476509 0.93 CYSLTR2 (0.42) CYSLTR2CYSLTR1EPHX2
SCHEMBL6476729 0.93 CYSLTR2 (0.40) CYSLTR2CYSLTR1EPHX2
SCHEMBL6490248 0.90 CYP3A4 (0.41) CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL6477002 0.89 FABP3 (0.43) CYSLTR2CYSLTR1EPHX2
SCHEMBL6477739 0.88 CYSLTR2 (0.40) CYP3A4CYSLTR2CYSLTR1IDO1TDO2
SCHEMBL6475547 0.85 CYSLTR2 (0.39) CYSLTR2CYSLTR1
SCHEMBL6485332 0.83 CYSLTR2 (0.41) CYSLTR2CYSLTR1IDO1TDO2
SCHEMBL6482915 0.83 CYSLTR2 (0.43) CYSLTR2CYSLTR1IDO1TDO2
SCHEMBL6490615 0.81 IDO1 (0.47) CYSLTR2CYSLTR1IDO1TDO2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933322-B2 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2005-08-23 US claimed
US-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH 2003-11-20 US claimed
US-6933322-B2 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2005-08-23 US disclosed
US-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH 2003-11-20 US 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-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus INSR, GPR119, SLC5A1 CYP3A4 417/4885CYP2D6 897/4885SLC6A2 845/4885

“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.