SCHEMBL3236014

SCHEMBL3236014

CC(C)(C(NC(=O)c1cccc(F)c1Cl)c1ccccc1)N1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 6/20 0.47
P2RX7 Q99572 11/20 0.40
ALDH1A1 P00352 2/20 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
SCHEMBL3240602 0.88 SLC6A9 (0.41) SLC6A9ALDH1A1
SCHEMBL3238470 0.88 SLC6A9 (0.46) SLC6A9P2RX7ALDH1A1
SCHEMBL3238677 0.87 SLC6A9 (0.62) SLC6A9P2RX7
SCHEMBL3234846 0.86 SLC6A9 (0.61) SLC6A9P2RX7
SCHEMBL3232882 0.84 SLC6A9 (0.45) SLC6A9P2RX7ALDH1A1
SCHEMBL3230685 0.83 ALDH1A1 (0.44) SLC6A9P2RX7ALDH1A1
SCHEMBL3240030 0.81 LMNA (0.36) SLC6A9ALDH1A1
SCHEMBL3239409 0.80 KLRK1 (0.46) ALDH1A1
SCHEMBL3238049 0.80 ITGA4 (0.49) SLC6A9
SCHEMBL3241918 0.79 ALDH1A1 (0.43) SLC6A9ALDH1A1

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 SLC6A9 13/4885P2RX7 2285/4885ALDH1A1 1356/4885

“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.