SCHEMBL16699987

SCHEMBL16699987

N[C@H]([C]=O)CCCCNC(=O)[C@@H](N)CCCCNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CCCCCCCCCCCOc1ccc(C(=O)O)cc1)C(=O)O)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 4/20 0.45
▸ GLP1R P43220 8/20 0.43
▸ FNTA P49354 2/20 0.42
▸ FNTB P49356 2/20 0.42
▸ ITGB3 P05106 3/20 0.41
▸ ITGA2B P08514 3/20 0.41
▸ PGGT1B P53609 1/20 0.41
▸ FOLH1 Q04609 3/20 0.40

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
SCHEMBL4538758 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL4539079 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL15530707 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL15530469 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL16699151 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL4542732 1.00 NOD1 (0.45) NOD1GLP1RFNTAFNTBITGB3
SCHEMBL15530540 0.95 ITGB3 (0.44) NOD1GLP1RITGB3ITGA2BFOLH1
SCHEMBL15530790 0.95 ITGB3 (0.44) NOD1GLP1RITGB3ITGA2BFOLH1
SCHEMBL15529969 0.95 ITGB3 (0.44) NOD1GLP1RITGB3ITGA2BFOLH1
SCHEMBL4533620 0.95 ITGB3 (0.44) NOD1GLP1RITGB3ITGA2BFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11518795-B2 Double-acylated GLP-1 derivatives NOVO NORDISK A/S (DK) 2022-12-06 — — US disclosed
US-20200123215-A1 Double-Acylated GLP-1 Derivatives NOVO NORDISK AS (DK) 2020-04-23 — — US disclosed
US-10604554-B2 Double-acylated GLP-1 derivatives NOVO NORDISK A/S (DK) 2020-03-31 — — US disclosed
US-20180244742-A1 Double-Acylated GLP-1 Derivatives NOVO NORDISK AS (DK) 2018-08-30 — — US disclosed
US-20150133374-A1 Double-Acylated GLP-1 Derivatives NOVO NORDISK A/S (DK) 2015-05-14 — — 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 (5 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-20150133374-A1 Double-Acylated GLP-1 Derivatives GLP1R, GIPR, GPR119 NOD1 1050/4885GLP1R 1/4885FNTA 2843/4885
US-10604554-B2 Double-acylated GLP-1 derivatives GLP1R, GIPR, GPR119 NOD1 1050/4885GLP1R 1/4885FNTA 2843/4885
US-20180244742-A1 Double-Acylated GLP-1 Derivatives GLP1R, GIPR, GPR119 NOD1 1021/4885GLP1R 1/4885FNTA 2841/4885
US-20200123215-A1 Double-Acylated GLP-1 Derivatives GLP1R, GIPR, GPR119 NOD1 1050/4885GLP1R 1/4885FNTA 2843/4885
US-11518795-B2 Double-acylated GLP-1 derivatives GLP1R, GIPR, GPR119 NOD1 1050/4885GLP1R 1/4885FNTA 2843/4885

“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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