SCHEMBL3240255

SCHEMBL3240255

CCC(C)(C(NC(=O)c1c(C)cccc1Cl)c1ccccc1)N(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.49
ITGB1 P05556 11/20 0.43
ITGA4 P13612 11/20 0.43
ITGB7 P26010 5/20 0.43
ITGA2 P17301 1/20 0.43
ITGB2 P05107 1/20 0.43
ICAM1 P05362 1/20 0.43
ITGAL P20701 1/20 0.43
CCR5 P51681 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.39
TYK2 P29597 1/20 0.39
SLC6A9 P48067 2/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL3237956 0.92 L3MBTL1 (0.46) UTS2RITGB2ICAM1ITGALCCR5
SCHEMBL3906111 0.86 UTS2R (0.50) UTS2RITGB1ITGA4ITGB7ITGA2
SCHEMBL3237990 0.83 L3MBTL1 (0.47) UTS2RITGB2ICAM1ITGALCCR5
SCHEMBL3238600 0.82 UTS2R (0.46) UTS2RL3MBTL1LMNA
SCHEMBL3238502 0.79 L3MBTL1 (0.47) UTS2RITGB2ICAM1ITGALL3MBTL1
SCHEMBL3902170 0.78 LMNA (0.44) UTS2RITGB1ITGA4L3MBTL1SLC6A9
SCHEMBL3241715 0.78 SLC6A9 (0.42) UTS2RITGB1ITGA4ITGB7ITGA2
SCHEMBL3907148 0.77 SLC6A9 (0.47) UTS2RITGB2ICAM1ITGALL3MBTL1
SCHEMBL3239589 0.75 L3MBTL1 (0.40) UTS2RITGB2ICAM1ITGALCCR5
SCHEMBL3244398 0.75 CTSS (0.55) SLC6A9

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 6 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-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
US-20080287547-A1 Glycine Transport Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-20 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-20080287547-A1 Glycine Transport Inhibitors SLC18A2, SLC6A5, SLC1A2 UTS2R 3013/4885ITGB1 4772/4885ITGA4 4778/4885

“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.