SCHEMBL3240043

SCHEMBL3240043

CN(CCO)C1(C(NC(=O)c2cccc(C(F)(F)F)c2Cl)c2ccccc2)CCCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 17/20 0.56
CTSS P25774 3/20 0.46
CTSK P43235 2/20 0.46

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
SCHEMBL3245475 0.91 SLC6A9 (0.57) SLC6A9CTSSCTSK
SCHEMBL13303987 0.90 CTSS (0.45) SLC6A9CTSS
SCHEMBL3231206 0.90 SLC6A9 (0.62) SLC6A9CTSSCTSK
SCHEMBL3237575 0.89 SLC6A9 (0.61) SLC6A9CTSSCTSK
SCHEMBL8264816 0.88 SLC6A9 (0.59) SLC6A9CTSSCTSK
Hydrochloric Acid SCHEMBL3243445 0.87 SLC6A9 (0.58) SLC6A9CTSSCTSK
SCHEMBL3238730 0.87 SLC6A9 (0.50) SLC6A9CTSSCTSK
SCHEMBL3245146 0.86 SLC6A9 (0.58) SLC6A9CTSSCTSK
SCHEMBL17684029 0.80 SLC6A9 (0.62) SLC6A9CTSSCTSK
SCHEMBL3239482 0.80 SLC6A9 (0.62) SLC6A9CTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745642-B2 Glycine transport inhibitors GLAXO GROUP LIMITED (GB) 2010-06-29 US disclosed
US-7745642-B2 Glycine transport inhibitors GLAXO GROUP LIMITED (GB) 2010-06-29 US disclosed
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
WO-2006067423-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2006-06-29 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-20080287547-A1 Glycine Transport Inhibitors SLC18A2, SLC6A5, SLC1A2 SLC6A9 13/4885CTSS 2250/4885CTSK 2569/4885

“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.