SCHEMBL5223473

SCHEMBL5223473

CNC[C@H](O)[C@H](Cc1ccccc1)N(C(=O)O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 5/20 0.41
OPRK1 P41145 5/20 0.41
OPRM1 P35372 2/20 0.41
ABCB1 P08183 1/20 0.39
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 2/20 0.39
BCHE P06276 1/20 0.39
BACE1 P56817 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 1/20 0.38
RIPK1 Q13546 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 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
SCHEMBL5223463 1.00 OPRD1 (0.41) OPRD1OPRK1OPRM1ABCB1SLC6A2
SCHEMBL5224985 0.87 OPRM1 (0.39) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL5224996 0.87 OPRM1 (0.39) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL5930323 0.87 SLC6A2 (0.43) SLC6A2SLC6A4RIPK1
SCHEMBL5930327 0.87 SLC6A2 (0.43) SLC6A2SLC6A4RIPK1
SCHEMBL609658 0.86 ANPEP (0.42) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL609656 0.86 ANPEP (0.42) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL4869209 0.85 ABCB1 (0.39) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL4869199 0.85 ABCB1 (0.39) OPRD1OPRK1OPRM1ABCB1BCHE
SCHEMBL5223492 0.85 OPRM1 (0.40) OPRD1OPRK1OPRM1ABCB1BCHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567488-B1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LTD (GB) 2007-02-21 EP disclosed
US-20060229302-A1 Tricyclic indole derivatives and their use in the treatment of alzheimer's disease GLAXO GROUP LIMITED (GB) 2006-10-12 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-20060229302-A1 Tricyclic indole derivatives and their use in the treatment of alzheimer's disease BACE2, BACE1, PSEN2 OPRD1 505/4885OPRK1 437/4885OPRM1 426/4885

“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.