SCHEMBL3237933

SCHEMBL3237933

COc1ccc(Cl)c(OC)c1C(=O)NC(c1ccccc1)C1(N(C)C)CCCC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.46
TAS1R1 Q7RTX1 4/20 0.46
TAS1R2 Q8TE23 4/20 0.46
SLC6A9 P48067 7/20 0.45
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL3237351 0.88 SLC6A9 (0.51) SLC6A9ALDH1A1
SCHEMBL3240768 0.86 SLC6A9 (0.58) SLC6A9ALDH1A1KMT2A
SCHEMBL3237485 0.84 SLC6A9 (0.48) SLC6A9ALDH1A1LMNAL3MBTL1
SCHEMBL13303916 0.83 SLC6A9 (0.47) TAS1R3TAS1R1SLC6A9ALDH1A1KMT2A
SCHEMBL3233042 0.82 SLC6A9 (0.52) TAS1R3TAS1R1TAS1R2SLC6A9ALDH1A1
SCHEMBL3236972 0.82 SLC6A9 (0.47) SLC6A9
SCHEMBL3240614 0.81 SLC6A9 (0.56) SLC6A9
SCHEMBL8264425 0.80 SLC6A9 (0.50) SLC6A9ALDH1A1KMT2A
SCHEMBL3239398 0.80 SLC6A9 (0.55) SLC6A9
SCHEMBL3237710 0.80 ALDH1A1 (0.42) SLC6A9ALDH1A1KMT2A

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-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 TAS1R3 3167/4885TAS1R1 2565/4885TAS1R2 3054/4885

“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.