SCHEMBL3237485

SCHEMBL3237485

COc1cc(Cl)cc(Cl)c1C(=O)NC(c1ccccc1)C1(N(C)C)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 9/20 0.48
ALDH1A1 P00352 4/20 0.40
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ACLY P53396 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL13303916 0.91 SLC6A9 (0.47) SLC6A9ALDH1A1MAPK1LMNARXFP1
SCHEMBL3237567 0.90 SLC6A9 (0.47) SLC6A9ALDH1A1
SCHEMBL3237351 0.88 SLC6A9 (0.51) SLC6A9ALDH1A1
SCHEMBL3237145 0.84 AVPR2 (0.43) SLC6A9ALDH1A1L3MBTL1LMNANPSR1
SCHEMBL3240768 0.84 SLC6A9 (0.58) SLC6A9ALDH1A1MAPK1
SCHEMBL3238379 0.84 ACLY (0.45) SLC6A9ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL3237933 0.84 TAS1R3 (0.46) SLC6A9ALDH1A1L3MBTL1LMNA
SCHEMBL3243915 0.83 SLC6A9 (0.47) SLC6A9ALDH1A1
SCHEMBL3243558 0.82 ROCK2 (0.44) SLC6A9ALDH1A1MAPK1LMNARXFP1
SCHEMBL3240614 0.81 SLC6A9 (0.56) 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 4 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

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 13/4885ALDH1A1 1356/4885MAPK1 2443/4885

“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.