SCHEMBL3230762

SCHEMBL3230762

COc1cc(C)c(C(=O)NC(c2ccccc2)C2(N(C)C)CCCC2)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 11/20 0.45
SLC6A5 Q9Y345 1/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
TP53 P04637 1/20 0.40
GPR139 Q6DWJ6 1/20 0.39
CCR5 P51681 1/20 0.39
TACR1 P25103 1/20 0.39
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 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
SCHEMBL3236708 0.89 SLC6A9 (0.48) SLC6A9SLC6A5KMT2AMEN1
SCHEMBL3233235 0.87 MEN1 (0.42) KMT2AMEN1ALDH1A1MAPK1
SCHEMBL3237783 0.86 SLC6A9 (0.47) SLC6A9SLC6A5CCR5
SCHEMBL3243915 0.86 SLC6A9 (0.47) SLC6A9SLC6A5ALDH1A1
SCHEMBL13780494 0.86 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3230781 0.86 SLC6A9 (0.59) SLC6A9SLC6A5
SCHEMBL3034261 0.86 SLC6A9 (0.44) SLC6A9SLC6A5KMT2AMEN1ALDH1A1
SCHEMBL3023849 0.85 SLC6A9 (0.46) SLC6A9SLC6A5KMT2ATP53
SCHEMBL3233042 0.83 SLC6A9 (0.52) SLC6A9SLC6A5ALDH1A1
SCHEMBL3240768 0.83 SLC6A9 (0.58) SLC6A9SLC6A5KMT2AMEN1ALDH1A1

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 SLC6A9 13/4885SLC6A5 2/4885KMT2A 1871/4885

“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.