SCHEMBL6092898

SCHEMBL6092898

CCC[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H]1C(=O)N(C)CCO[C@@H]1c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.42
MME P08473 1/20 0.42
GPR88 Q9GZN0 5/20 0.39
XIAP P98170 4/20 0.38
BIRC2 Q13490 2/20 0.38
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CCKBR P32239 1/20 0.36
CCR2 P41597 2/20 0.36

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
SCHEMBL3343067 0.83 ACE (0.50) ACEMMECTSBCTSSCTSK
SCHEMBL3341491 0.77 PSEN1 (0.46) ACEMME
SCHEMBL3346941 0.72 ACE (0.40) ACEMMEMEN1KMT2ACCKBR
SCHEMBL3343100 0.72 ACE (0.42) ACEMMECTSBCTSSCTSK
SCHEMBL3340791 0.68 PSEN1 (0.56) ACEMME
SCHEMBL3343191 0.66 PSEN1 (0.45) ACEMME
SCHEMBL6211227 0.66 PSEN1 (0.45) ACEMME
SCHEMBL3342540 0.64 PSEN1 (0.42) ACEMMEMEN1KMT2A
SCHEMBL3343313 0.63 HSD17B10 (0.50) ACEMMEMEN1KMT2A
SCHEMBL3346896 0.63 HSD17B10 (0.50) ACEMMEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089346-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-04-27 US claimed

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-20060089346-A1 Novel lactams and uses thereof BACE1, BACE2, APH1B ACE 139/4885MME 345/4885GPR88 3528/4885

“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.