SCHEMBL21991002

SCHEMBL21991002

CN[C@H](CO)CCC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.45
ENPEP Q07075 1/20 0.45
ALDH1A1 P00352 1/20 0.39
LMNA P02545 3/20 0.33
SLC15A2 Q16348 1/20 0.33
CNR1 P21554 1/20 0.30
ADRA1A P35348 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL24390485 1.00 ANPEP (0.45) ANPEPENPEPALDH1A1LMNASLC15A2
SCHEMBL22994945 0.88 ANPEP (0.56) ANPEPENPEPALDH1A1LMNASLC15A2
SCHEMBL26864412 0.82 ANPEP (0.45) ANPEPENPEPALDH1A1LMNASLC15A2
SCHEMBL16710258 0.82 ANPEP (0.67) ANPEPENPEPKDM4E
SCHEMBL16768817 0.80 ANPEP (0.70) ANPEPENPEPALDH1A1LMNASLC15A2
SCHEMBL25943327 0.80 ANPEP (0.70) ANPEPENPEPALDH1A1LMNASLC15A2
SCHEMBL16710256 0.80 ANPEP (0.44) ANPEPENPEP
SCHEMBL20353370 0.78 KISS1R (0.43) ANPEPENPEPALDH1A1TDP1
SCHEMBL2758953 0.78 TSHR (0.48) ANPEPENPEPALDH1A1LMNAKDM4E
SCHEMBL8861959 0.78 TSHR (0.48) ANPEPENPEPALDH1A1LMNAKDM4E

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-11174301-B2 Peptide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-16 US disclosed
US-20200140505-A1 PEPTIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMTED (JP) 2020-05-07 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-20200140505-A1 PEPTIDE COMPOUND GIPR, GLP1R, GRPR ANPEP 109/4885ENPEP 244/4885ALDH1A1 4573/4885
US-11174301-B2 Peptide compound GIPR, GLP1R, GRPR ANPEP 109/4885ENPEP 244/4885ALDH1A1 4573/4885

“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.