SCHEMBL7943709

SCHEMBL7943709

CC(C)CCNC(=O)[C@H](C)N

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 5/20 0.61
DNPEP Q9ULA0 4/20 0.61
RNPEP Q9H4A4 4/20 0.53
LAP3 P28838 3/20 0.49
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
DPP7 Q9UHL4 1/20 0.41
SLC15A1 P46059 1/20 0.41
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CAPN9 O14815 1/20 0.41
CAPN1 P07384 1/20 0.41
CTSB P07858 1/20 0.41
MAPK1 P28482 1/20 0.41
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
TERT O14746 1/20 0.40

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
SCHEMBL7941699 1.00 ANPEP (0.61) ANPEPDNPEPRNPEPLAP3RAB9A
SCHEMBL19474113 1.00 ANPEP (0.61) ANPEPDNPEPRNPEPLAP3RAB9A
Hydrochloric Acid SCHEMBL8054071 0.98 ANPEP (0.59) ANPEPDNPEPRNPEPLAP3RAB9A
Hydrochloric Acid SCHEMBL8041160 0.98 ANPEP (0.59) ANPEPDNPEPRNPEPLAP3RAB9A
SCHEMBL7943423 0.87 ANPEP (0.49) ANPEPDNPEPRNPEPLAP3DPP7
SCHEMBL7945922 0.87 ANPEP (0.49) ANPEPDNPEPRNPEPLAP3DPP7
SCHEMBL9140084 0.85 USP2 (0.50) ANPEPDNPEPDPP7SLC15A1TERT
SCHEMBL9140089 0.85 USP2 (0.50) ANPEPDNPEPDPP7SLC15A1TERT
SCHEMBL7936521 0.85 DPP7 (0.50) ANPEPDNPEPRNPEPLAP3DPP7
Hydrochloric Acid SCHEMBL8766670 0.83 USP2 (0.48) ANPEPDNPEPDPP7SLC15A1TERT

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
US-20100003276-A1 Methods for treating anthrax and inhibiting lethal factor HERMES JEFFERY D 2010-01-07 US disclosed
US-7504425-B2 Compounds useful in the treatment of anthrax and inhibiting lethal factor MERCK & CO., INC. (US) 2009-03-17 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-20100003276-A1 Methods for treating anthrax and inhibiting lethal factor ANTXR2, SERPINB1, APAF1 ANPEP 179/4885DNPEP 303/4885RNPEP 141/4885

“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.