SCHEMBL21166965

SCHEMBL21166965

NCCNC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C1CCCN1C(=O)Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
ACE P12821 4/20 0.41
REN P00797 2/20 0.41
ITGB3 P05106 4/20 0.39
ITGA2B P08514 4/20 0.39
F2 P00734 2/20 0.37
APLNR P35414 1/20 0.37
NTMT1 Q9BV86 1/20 0.37
DPP4 P27487 1/20 0.37
FAP Q12884 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
DPP7 Q9UHL4 1/20 0.37

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
SCHEMBL21166957 0.98 ACE (0.43) ITGB1ITGA4ACERENITGB3
SCHEMBL21166966 0.92 ITGB1 (0.44) ITGB1ITGA4ACERENITGB3
SCHEMBL21166989 0.89 ACE (0.45) ITGB1ITGA4ACERENITGB3
SCHEMBL21167022 0.87 APLNR (0.46) ITGB1ITGA4ACEITGB3ITGA2B
SCHEMBL21350913 0.86 ITGB1 (0.38) ITGB1ITGA4RENITGB3ITGA2B
SCHEMBL21166987 0.85 ITGB3 (0.41) ITGB1ITGA4RENITGB3ITGA2B
SCHEMBL19681209 0.84 NTMT1 (0.43) ITGB3ITGA2BAPLNRNTMT1
SCHEMBL19681283 0.81 APLNR (0.44) ITGB3ITGA2BF2APLNRNTMT1
SCHEMBL21350914 0.79 ITGB1 (0.42) ITGB1ITGA4RENITGB3ITGA2B
SCHEMBL21349175 0.78 ITGB1 (0.46) ITGB1ITGA4ACERENITGB3

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-20210386830-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID ADOCIA (FR) 2021-12-16 US disclosed
US-11191812-B2 Compositions in the form of an injectable aqueous solution comprising human glucagon and a co-polyamino acid ADOCIA (FR) 2021-12-07 US disclosed
US-11129877-B2 Compositions in the form of an injectable aqueous solution comprising amylin, an amylin agonist receptor or an amylin analogue and a co-polyamino acid ADOCIA (FR) 2021-09-28 US disclosed
US-20200306379-A1 INJECTABLE PH 7 SOLUTION COMPRISING AT LEAST ONE BASAL INSULIN HAVING A PI FROM 5.8 TO 8.5 AND A CO-POLYAMINO ACID BEARING CARBOXYLATE CHARGES AND HYDROPHOBIC RADICALS ADOCIA (FR) 2020-10-01 US disclosed
US-20190328842-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING AMYLIN, AN AMYLIN AGONIST RECEPTOR OR AN AMYLIN ANALOGUE AND A CO-POLYAMINO ACID ADOCIA (FR) 2019-10-31 US disclosed
US-20190275109-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID ADOCIA (FR) 2019-09-12 US disclosed
US-20190216931-A1 INJECTABLE PH 7 SOLUTION COMPRISING AT LEAST ONE BASAL INSULIN HAVING A PI FROM 5.8 TO 8.5 AND A CO-POLYAMINO ACID BEARING CARBOXYLATE CHARGES AND HYDROPHOBIC RADICALS ADOCIA (FR) 2019-07-18 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 (7 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-11191812-B2 Compositions in the form of an injectable aqueous solution comprising human glucagon and a co-polyamino acid GCG, GIPR, GLP1R ITGB1 4576/4885ITGA4 4207/4885ACE 2588/4885
US-20190275109-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID GCG, GIPR, GLP1R ITGB1 4540/4885ITGA4 4206/4885ACE 2785/4885
US-11129877-B2 Compositions in the form of an injectable aqueous solution comprising amylin, an amylin agonist receptor or an amylin analogue and a co-polyamino acid IAPP, GLP1R, INSR ITGB1 3600/4885ITGA4 3326/4885ACE 815/4885
US-20200306379-A1 INJECTABLE PH 7 SOLUTION COMPRISING AT LEAST ONE BASAL INSULIN HAVING A PI FROM 5.8 TO 8.5 AND A CO-POLYAMINO ACID BEARING CARBOXYLATE CHARGES AND HYDROPHOBIC RADICALS IAPP, INSR, IGFBP5 ITGB1 3057/4885ITGA4 2236/4885ACE 1462/4885
US-20190216931-A1 INJECTABLE PH 7 SOLUTION COMPRISING AT LEAST ONE BASAL INSULIN HAVING A PI FROM 5.8 TO 8.5 AND A CO-POLYAMINO ACID BEARING CARBOXYLATE CHARGES AND HYDROPHOBIC RADICALS IAPP, INSR, IGFBP5 ITGB1 3057/4885ITGA4 2236/4885ACE 1462/4885
US-20190328842-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING AMYLIN, AN AMYLIN AGONIST RECEPTOR OR AN AMYLIN ANALOGUE AND A CO-POLYAMINO ACID IAPP, GLP1R, INSR ITGB1 3600/4885ITGA4 3326/4885ACE 815/4885
US-20210386830-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID GCG, GIPR, GLP1R ITGB1 4576/4885ITGA4 4207/4885ACE 2588/4885

“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.