SCHEMBL21264570

SCHEMBL21264570

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nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.44
▸ ANPEP P15144 7/20 0.38
▸ RNPEP Q9H4A4 2/20 0.38
▸ DNPEP Q9ULA0 2/20 0.38
▸ SLC1A3 P43003 2/20 0.37
▸ SLC1A2 P43004 2/20 0.37
▸ SLC1A1 P43005 1/20 0.37
▸ CHRNB2 P17787 2/20 0.33
▸ CHRNA4 P43681 2/20 0.33
▸ CHRNB4 P30926 1/20 0.33
▸ CHRNA3 P32297 1/20 0.33
▸ FAAH O00519 1/20 0.32
▸ DPP4 P27487 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ LAP3 P28838 3/20 0.31
▸ ERAP1 Q9NZ08 1/20 0.31

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
SCHEMBL21283433 0.85 SLC7A5 (0.38) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL12214542 0.85 SLC7A5 (0.50) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL14224953 0.84 SLC7A5 (0.45) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL23408812 0.83 SLC7A5 (0.41) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL13144609 0.82 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL21283383 0.81 SLC7A5 (0.47) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL21283434 0.81 LMNA (0.46) FAAH
SCHEMBL10363543 0.79 SLC7A5 (0.48) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL10363544 0.79 SLC7A5 (0.48) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL14095412 0.79 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3

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-20190248733-A1 ORAL SUPPLEMENTS OF FATTY ACID AND AMINO ACID KETONE ESTERS TO IMPROVE METABOLIC, PHYSICAL AND COGNITIVE HEALTH BIKMAN BENJAMIN (US) 2019-08-15 — — 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-20190248733-A1 ORAL SUPPLEMENTS OF FATTY ACID AND AMINO ACID KETONE ESTERS TO IMPROVE METABOLIC, PHYSICAL AND COGNITIVE HEALTH BCKDK, BCAT2, HADHB SLC7A5 500/4885ANPEP 1224/4885RNPEP 1471/4885

“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.

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