SCHEMBL23643116

SCHEMBL23643116

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nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
GNPAT O15228 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
PTGS2 P35354 1/20 0.36
THPO P40225 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
REN P00797 2/20 0.33
ACE P12821 1/20 0.33
CASP1 P29466 1/20 0.32
PTPN1 P18031 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
SCHEMBL10308716 0.76 KDM4E (0.46) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL19709025 0.76 KDM4E (0.46) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL17424531 0.76 GNPAT (0.60) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL22648158 0.76 GNPAT (0.43) GNPATACEPTPN1
SCHEMBL13474992 0.75 KDM4E (0.42) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL23901238 0.75 ALDH1A1 (0.42) ALDH1A1TDP1ACE
SCHEMBL31181186 0.73 GNPAT (0.56) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL30799494 0.72 GNPAT (0.52) ALDH1A1GNPATKDM4EMAPTTHRB
SCHEMBL23643228 0.72 ALDH1A1 (0.39) ALDH1A1TDP1ACE
SCHEMBL18916659 0.71 SIRT6 (0.57) GNPAT

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-11306125-B2 PCSK9 antagonists bicyclo-compounds MERCK SHARP & DOHME CORP. (US) 2022-04-19 US disclosed
US-20210214395-A1 PCSK9 ANTAGONISTS BICYCLO-COMPOUNDS MERCK SHARP & DOHME LLC 2021-07-15 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 (2 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-20210214395-A1 PCSK9 ANTAGONISTS BICYCLO-COMPOUNDS PCSK9, PCSK7, PCSK6 ALDH1A1 4478/4885GNPAT 1774/4885KDM4E 2880/4885
US-11306125-B2 PCSK9 antagonists bicyclo-compounds PCSK9, PCSK7, PCSK6 ALDH1A1 4478/4885GNPAT 1774/4885KDM4E 2880/4885

“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.