SCHEMBL2841652

SCHEMBL2841652

O=C(O)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 0.52
SLC6A11 P48066 1/20 0.52
BCHE P06276 6/20 0.49

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
SCHEMBL8578649 1.00 BACE1 (0.52) BACE1SLC6A11BCHE
SCHEMBL7443833 0.91 BACE1 (0.44) BACE1SLC6A11BCHE
SCHEMBL7305633 0.89 BACE1 (0.60) BACE1SLC6A11BCHE
SCHEMBL7306846 0.89 BACE1 (0.60) BACE1SLC6A11BCHE
SCHEMBL9012913 0.86 BACE1 (0.50) BACE1SLC6A11BCHE
SCHEMBL7610027 0.84 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL7610032 0.84 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL7607271 0.83 BACE1 (0.55) BACE1SLC6A11BCHE
SCHEMBL14636685 0.83 BCHE (0.53) BACE1SLC6A11BCHE
SCHEMBL14637748 0.83 BCHE (0.53) BACE1SLC6A11BCHE

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
EP-2235008-B1 AMIDE COMPOUNDS AS BOOSTERS OF ANTIVIRALS JANSSEN SCIENCES IRELAND UC (IE) 2016-03-16 EP disclosed
US-8350048-B2 Amide compounds as boosters of antivirals JANSSEN R&D IRELAND (IE) 2013-01-08 US disclosed
US-20100305073-A1 AMIDE COMPOUNDS AS BOOSTERS OF ANTIVIRALS TIBOTEC BVBA 2010-12-02 US disclosed
EP-2235008-A2 AMIDE COMPOUNDS AS BOOSTERS OF ANTIVIRALS Tibotec Pharmaceuticals (IE) 2010-10-06 EP disclosed
WO-2009071650-A2 AMIDE COMPOUNDS AS BOOSTERS OF ANTIVIRALS TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-06-11 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-20100305073-A1 AMIDE COMPOUNDS AS BOOSTERS OF ANTIVIRALS CYP3A5, CYP3A4, CYP3A43 BACE1 823/4885SLC6A11 2155/4885BCHE 93/4885

“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.