SCHEMBL4994294

SCHEMBL4994294

CS(=O)(=O)Nc1ccc(OCC(O)CNCC(Cc2c(F)cccc2F)c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.59
SLC6A2 P23975 1/20 0.59
SLC6A3 Q01959 1/20 0.59

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
SCHEMBL4216139 1.00 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4206410 0.92 KCNH2 (0.61) KCNH2SLC6A2SLC6A3
SCHEMBL4196746 0.92 KCNH2 (0.61) KCNH2SLC6A2SLC6A3
SCHEMBL4215806 0.91 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4205134 0.91 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4207742 0.88 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4216154 0.88 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4211396 0.87 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4204035 0.87 KCNH2 (0.59) KCNH2SLC6A2SLC6A3
SCHEMBL4205137 0.87 KCNH2 (0.65) KCNH2SLC6A2SLC6A3

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-7375136-B2 pH-dependent NMDA receptor antagonists EMORY UNIVERSITY (US) 2008-05-20 US disclosed
EP-1436258-A4 PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS UNIV EMORY (US) 2005-03-23 EP disclosed
US-20040138502-A1 Ph-dependent nmda receptor antagonists EMORY UNIVERSITY 2004-07-15 US disclosed
EP-1436258-A2 PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS Emory University (US) 2004-07-14 EP disclosed
WO-2002072542-A2 PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS EMORY UNIVERSITY (US) 2002-09-19 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-20040138502-A1 Ph-dependent nmda receptor antagonists GRIN1, GRIN2B, GRIN3A KCNH2 382/4885SLC6A2 2030/4885SLC6A3 999/4885

“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.