SCHEMBL25328112

SCHEMBL25328112

[CH2]CNC(=O)C(N)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.50
ANPEP P15144 3/20 0.46
RNPEP Q9H4A4 2/20 0.46
DNPEP Q9ULA0 2/20 0.46
LARS1 Q9P2J5 3/20 0.42
AAK1 Q2M2I8 2/20 0.41
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
ARG1 P05089 1/20 0.36
ARG2 P78540 1/20 0.36
SCN9A Q15858 3/20 0.35
CIT O14578 1/20 0.35

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
SCHEMBL13789959 0.83 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL8768451 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL11078076 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
Hydrochloric Acid SCHEMBL8624056 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
Hydrochloric Acid SCHEMBL8624053 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL11078078 0.81 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL9113004 0.79 DPP7 (0.52) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL3359437 0.78
SCHEMBL25326532 0.78
SCHEMBL1277891 0.78 ANPEP (0.68) SLC7A5ANPEPRNPEPDNPEP

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-20230234912-A1 NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS APICAL MOLECULAR BIOTECH CO., LTD. (TW) 2023-07-27 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-20230234912-A1 NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS FABP1, GLS2, SLC1A5 SLC7A5 25/4885ANPEP 236/4885RNPEP 349/4885

“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.