SCHEMBL6475622

SCHEMBL6475622

COc1ccc(COc2cccc3cc(NS(=O)(=O)C(F)(F)F)ccc23)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
HTR6 P50406 1/20 0.40
PDE5A O76074 1/20 0.39

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
SCHEMBL6477798 0.84 CYSLTR2 (0.52) CYSLTR2CYSLTR1
SCHEMBL6477257 0.83 IDO1 (0.43) MEN1KMT2AIDO1TDO2CYSLTR2
SCHEMBL6483436 0.83 PPARA (0.47) IDO1TDO2CYSLTR2CYSLTR1
SCHEMBL6490248 0.83 CYP3A4 (0.41) CYP3A4CYP2D6CYSLTR2CYSLTR1
SCHEMBL6484693 0.82 CYSLTR2 (0.43) CYSLTR2CYSLTR1
SCHEMBL6486039 0.82 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL6476521 0.82 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL6488463 0.82 CYSLTR2 (0.41) CYSLTR2CYSLTR1
SCHEMBL6490615 0.81 IDO1 (0.47) IDO1TDO2CYSLTR2CYSLTR1
SCHEMBL6485405 0.81 PLAU (0.43) IDO1TDO2CYSLTR2CYSLTR1

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-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 MEN1 723/4885KMT2A 1629/4885IDO1 1894/4885

“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.