SCHEMBL3230703

SCHEMBL3230703

COc1ccc(Cl)c(OC)c1C(=O)NC(c1ccccc1)C(C)(C)N1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.45
TAS1R1 Q7RTX1 4/20 0.45
TAS1R2 Q8TE23 4/20 0.45
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 2/20 0.41
SLC6A9 P48067 2/20 0.38
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 3/20 0.36
S1PR1 P21453 1/20 0.36
TP53 P04637 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 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
SCHEMBL3235815 0.93 TAS1R3 (0.43) TAS1R3TAS1R1TAS1R2ALDH1A1KMT2A
SCHEMBL3239749 0.88 DRD3 (0.44) ALDH1A1KMT2ASLC6A9GAA
SCHEMBL3241436 0.88 SLC6A9 (0.41) ALDH1A1KMT2ASLC6A9MAPTS1PR1
SCHEMBL3239591 0.86 KMT2A (0.47) ALDH1A1KMT2ASLC6A9KDM4EHSD17B10
SCHEMBL3236158 0.84 SLC6A9 (0.41) ALDH1A1KMT2ASLC6A9MAPTS1PR1
SCHEMBL3233013 0.82 SLC6A9 (0.42) TAS1R3TAS1R1TAS1R2ALDH1A1KMT2A
SCHEMBL3238315 0.81 ALDH1A1 (0.41) TAS1R3TAS1R1ALDH1A1KMT2AKDM4E
SCHEMBL13303997 0.80 S1PR1 (0.37) ALDH1A1KMT2ASLC6A9MAPTS1PR1
SCHEMBL3238547 0.80 SMN1; SMN2 (0.48) ALDH1A1KMT2AKDM4EHSD17B10MAPT
SCHEMBL12132690 0.80 SLC6A9 (0.40) ALDH1A1KMT2ASLC6A9KDM4EHSD17B10

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 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.