SCHEMBL3243976

SCHEMBL3243976

COc1ccc(C(=O)NC(c2ccccc2)C(C)(C)N2CCCC2C)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
ALDH1A1 P00352 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
HSD11B1 P28845 1/20 0.40
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.37
P2RX7 Q99572 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37

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
SCHEMBL3242223 0.89 NPC1 (0.40) LMNAALDH1A1KMT2AITGB3ITGA2B
SCHEMBL3243834 0.88 P2RX7 (0.39) ALDH1A1MEN1KMT2AMAPK1P2RX7
SCHEMBL3237083 0.83 POLB (0.42) LMNAALDH1A1ITGB3ITGA2B
SCHEMBL3232907 0.81 ALDH1A1 (0.39) LMNAALDH1A1ITGB3ITGA2B
SCHEMBL3240097 0.80 SLC6A9 (0.46) LMNAALDH1A1
SCHEMBL3244796 0.80 TAS1R3 (0.44) LMNAALDH1A1KMT2AHSD11B1P2RX7
SCHEMBL3240092 0.80 SLC6A9 (0.47) ALDH1A1MEN1KMT2AGAA
SCHEMBL3236750 0.78 ALDH1A1 (0.39) LMNAALDH1A1MEN1KMT2AHSD11B1
SCHEMBL13631388 0.78 RAB9A (0.51) LMNAMEN1KMT2AGAA
SCHEMBL3245182 0.78 HPGD (0.45) LMNAALDH1A1MEN1KMT2AGAA

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 LMNA 4449/4885ALDH1A1 1356/4885MEN1 2501/4885

“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.