SCHEMBL3245066

SCHEMBL3245066

COc1ccc(Cl)c(C(=O)NC(c2ccccc2)C2(N(C)C)CCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 7/20 0.43
P2RY12 Q9H244 1/20 0.43
TYK2 P29597 1/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ANO1 Q5XXA6 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SLC6A9 P48067 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL3237602 0.87 GPR139 (0.50) P2RX7MEN1KMT2AALDH1A1SLC6A9
SCHEMBL3233235 0.86 MEN1 (0.42) P2RX7MEN1KMT2ARAB9AALDH1A1
SCHEMBL3238379 0.82 ACLY (0.45) MEN1KMT2AALDH1A1SLC6A9MAPK1
SCHEMBL3240099 0.82 CRHR1 (0.46) TYK2MEN1KMT2AANO1ALDH1A1
SCHEMBL3237145 0.81 AVPR2 (0.43) MEN1KMT2AALDH1A1SLC6A9LMNA
SCHEMBL4356706 0.81 LMNA (0.51) SLC6A9MAPK1LMNA
SCHEMBL4359374 0.81 SLC6A9 (0.41) MEN1KMT2ARAB9ASLC6A9LMNA
SCHEMBL3244199 0.81 MEN1 (0.49) P2RX7MEN1KMT2ARAB9AALDH1A1
SCHEMBL3238270 0.80 ALDH1A1 (0.57) MEN1KMT2ARAB9AALDH1A1SLC6A9
SCHEMBL3230762 0.80 SLC6A9 (0.45) MEN1KMT2AALDH1A1SLC6A9MAPK1

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 7 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
WO-2006067423-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2006-06-29 WO 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 P2RX7 2285/4885P2RY12 2421/4885TYK2 4334/4885

“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.