SCHEMBL21166964

SCHEMBL21166964

COC(=O)CCC(NC(=O)C1CCCN1C(=O)CC(C)CCCC(C)CCCC(C)C)C(=O)NCCCCC(NC(=O)C(CCC(=O)OC)NC(=O)C1CCCN1C(=O)CC(C)CCCC(C)CCCC(C)C)C(=O)NCCN

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.43
REN P00797 1/20 0.43
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
PLK1 P53350 1/20 0.38
NMUR2 Q9GZQ4 1/20 0.38
NMUR1 Q9HB89 1/20 0.38
NTMT1 Q9BV86 2/20 0.37
ACE P12821 3/20 0.37
MMP1 P03956 1/20 0.36
MMP3 P08254 1/20 0.36
NMT2 O60551 1/20 0.35
NMT1 P30419 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL21350918 0.95 ITGB1 (0.41) APLNRRENITGB1ITGA4PLK1
SCHEMBL21350667 0.89 REN (0.41) APLNRRENITGB1ITGA4PLK1
SCHEMBL21166937 0.87 ITGB1 (0.47) APLNRRENITGB1ITGA4NMUR2
SCHEMBL21167115 0.82 ITGB1 (0.44) APLNRRENITGB1ITGA4NMUR2
SCHEMBL24139978 0.81 CYP2D6 (0.37)
SCHEMBL21350914 0.80 ITGB1 (0.42) APLNRRENITGB1ITGA4NTMT1
SCHEMBL21350913 0.79 ITGB1 (0.38) APLNRRENITGB1ITGA4NTMT1
SCHEMBL24137332 0.79 APLNR (0.45) APLNRRENACENMT2NMT1
SCHEMBL22478892 0.78 ITGB1 (0.44) APLNRRENITGB1ITGA4NMUR2
SCHEMBL21167022 0.77 APLNR (0.46) APLNRITGB1ITGA4NMUR2NMUR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210401943-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) 2021-12-30 US disclosed
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 (8 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 APLNR 634/4885REN 558/4885ITGB1 4576/4885
US-20190275109-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID GCG, GIPR, GLP1R APLNR 762/4885REN 715/4885ITGB1 4540/4885
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 APLNR 24/4885REN 506/4885ITGB1 3600/4885
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 APLNR 1918/4885REN 1165/4885ITGB1 3057/4885
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 APLNR 1918/4885REN 1165/4885ITGB1 3057/4885
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 APLNR 24/4885REN 506/4885ITGB1 3600/4885
US-20210386830-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING HUMAN GLUCAGON AND A CO-POLYAMINO ACID GCG, GIPR, GLP1R APLNR 634/4885REN 558/4885ITGB1 4576/4885
US-20210401943-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 APLNR 24/4885REN 506/4885ITGB1 3600/4885

“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.