SCHEMBL21440820

SCHEMBL21440820

CNCCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.40
▸ TSHR P16473 2/20 0.39
▸ CES2 O00748 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CA12 O43570 4/20 0.34
▸ CA1 P00915 4/20 0.34
▸ CA2 P00918 4/20 0.34
▸ CA4 P22748 4/20 0.34
▸ CA9 Q16790 4/20 0.34
▸ CA14 Q9ULX7 4/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ RECQL P46063 1/20 0.32

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
SCHEMBL24253207 0.95 TSHR (0.44) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL12147645 0.91 TSHR (0.47) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL21440826 0.89 MEN1 (0.41) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL19544555 0.89 MEN1 (0.41) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL21440855 0.89 MEN1 (0.41) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL12641023 0.89 MEN1 (0.41) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL12118184 0.89 MEN1 (0.41) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL21440818 0.88 TSHR (0.39) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL21242896 0.88 CES2 (0.42) GLP1RTSHRCES2MEN1KMT2A
SCHEMBL21242696 0.88 CES2 (0.42) GLP1RTSHRCES2MEN1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230143604-A1 QW DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-11 — — US disclosed
US-20220135638-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-05-05 — — US disclosed
US-20220016215-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-01-20 — — US disclosed
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
WO-2020067557-A2 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-04-02 — — WO disclosed
US-10435445-B2 Peptide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-10-08 — — 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 (6 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 GLP1R 2/4885TSHR 57/4885CES2 4494/4885
US-20220016215-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, GRPR GLP1R 2/4885TSHR 66/4885CES2 4794/4885
US-20230143604-A1 QW DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, GRPR GLP1R 2/4885TSHR 84/4885CES2 4566/4885
US-11174301-B2 Peptide compound GIPR, GLP1R, GRPR GLP1R 2/4885TSHR 57/4885CES2 4494/4885
US-10435445-B2 Peptide compound GIPR, GLP1R, GRPR GLP1R 2/4885TSHR 64/4885CES2 4534/4885
US-20220135638-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, VIPR1 GLP1R 2/4885TSHR 69/4885CES2 3756/4885

“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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