SCHEMBL599391

SCHEMBL599391

C[C@@H](C(=O)O)N(C(=O)OCC1c2ccccc2-c2ccccc21)c1cccnc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 3/20 0.41
FABP5 Q01469 3/20 0.38
FABP7 O15540 2/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 2/20 0.37
MDM4 O15151 2/20 0.37
TP53 P04637 2/20 0.37
CASP3 P42574 1/20 0.36
LMNA P02545 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
SCHEMBL30416398 1.00 PTGIR (0.41) PTGIRFABP5FABP7HTTKMT2A
SCHEMBL19668362 1.00 PTGIR (0.41) PTGIRFABP5FABP7HTTKMT2A
SCHEMBL31210304 1.00 PTGIR (0.41) PTGIRFABP5FABP7HTTKMT2A
SCHEMBL1905118 0.89 FABP5 (0.44) FABP5FABP7KMT2AMDM4TP53
SCHEMBL19668361 0.88 FABP5 (0.40) FABP5FABP7KMT2AMDM4TP53
SCHEMBL1885672 0.88 FABP5 (0.40) FABP5FABP7KMT2AMDM4TP53
SCHEMBL5494109 0.81 FABP5 (0.43) PTGIRFABP5FABP7KMT2AMDM4
SCHEMBL3902426 0.81 GPBAR1 (0.41)
SCHEMBL6629444 0.81 FABP5 (0.40) PTGIRFABP5FABP7KMT2AMDM4
SCHEMBL18301508 0.81 FABP5 (0.39) FABP5FABP7KMT2AMDM4TP53

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12098218-B2 Process for the manufacture of degarelix and its intermediates Fresenius Kabi iPSUM S.r.l (IT) 2024-09-24 US disclosed
US-11773150-B2 Antibody peptide conjugates that have agonist activity at both the glucagon and glucagon-like peptide 1 receptors MERCK SHARP & DOHME LLC (US) 2023-10-03 US disclosed
US-20220177521-A1 PROCESS FOR THE PREPARATION OF DEGARELIX Fresenius Kabi Ipsum S.R.L. (IT) 2022-06-09 US disclosed
US-11332495-B2 Process for the preparation of Degarelix acetate and Degarelix acetate-mannitol premix RK Pharma Solutions LLC (US) 2022-05-17 US disclosed
EP-3981781-A1 PROCESS FOR THE MANUFACTURE OF DEGARELIX AND ITS INTERMEDIATES Fresenius Kabi iPSUM S.r.l. (IT) 2022-04-13 EP disclosed
US-20220033443-A1 PROCESS FOR THE MANUFACTURE OF DEGARELIX AND ITS INTERMEDIATES Fresenius Kabi iPSUM S.r.l (IT) 2022-02-03 US disclosed
US-20210094984-A1 Process for the preparation of Degarelix acetate and Degarelix acetate-mannitol premix CITIBANK, N.A. 2021-04-01 US disclosed
US-20200392197-A1 ANTIBODY PEPTIDE CONJUGATES THAT HAVE AGONIST ACTIVITY AT BOTH THE GLUCAGON AND GLUCAGON-LIKE PEPTIDE 1 RECEPTORS MERCK SHARP & DOHME CORP. (US) 2020-12-17 US disclosed
US-10800826-B2 Antibody peptide conjugates that have agonist activity at both the glucagon and glucagon-like peptide 1 receptors MERCK SHARP & DOHME CORP. (US) 2020-10-13 US disclosed
US-10683334-B2 Aqueously soluble and chemically stable glucagon peptides INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2020-06-16 US disclosed
EP-1226146-A2 QUINOLINE AND NAPHTHYRIDINE CARBOXYLIC ACID ANTIBACTERIALS ABBOTT LABORATORIES (US) 2002-07-31 EP disclosed
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials ABBOTT LABORATORIES 2002-04-25 US disclosed
WO-2001058471-A2 NOVEL AMINO ACID AND PEPTIDE INHIBITORS OF STAPHYLOCOCCUS VIRULENCE INTERMUNE, INC. (US) 2001-08-16 WO disclosed
WO-2001032655-A2 QUINOLINE AND NAPHTHYRIDINE CARBOXYLIC ACID ANTIBACTERIALS ABBOTT LABORATORIES (US) 2001-05-10 WO disclosed
US-6229011-B1 BINDING INHIBITORS BETWEEN VASCULAR ADHESION MOLECULE-1 AND ALPHA. BETA.INTEGRIN; USEFUL FOR THE TREATMENT OF CHRONIC INFLAMMATORY DISEASES SUCH AS MULTIPLE SCLEROSIS, ASTHMA, AND INFLAMMATORY BOWEL DISEASE HOFFMAN-LA ROCHE INC. 2001-05-08 US disclosed
EP-1005445-A1 N-ALKANOYLPHENYLALANINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-07 EP disclosed
EP-1005446-A1 N-AROYLPHENYLALANINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-07 EP disclosed
WO-1999065932-A1 TETRAPEPTIDES, ANALOGS AND PEPTIDOMIMETICS WHICH BIND SELECTIVELY MAMMALIAN OPIOID RECEPTORS SEPRACOR, INC. (US) 1999-12-23 WO disclosed
WO-1999010312-A1 N-ALKANOYLPHENYLALANINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-03-04 WO disclosed
WO-1999010313-A1 N-AROYLPHENYLALANINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 1999-03-04 WO 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 (10 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-20220177521-A1 PROCESS FOR THE PREPARATION OF DEGARELIX VIP, PEPD, SSTR4 PTGIR 1389/4885FABP5 3455/4885FABP7 4010/4885
US-11773150-B2 Antibody peptide conjugates that have agonist activity at both the glucagon and glucagon-like peptide 1 receptors GLP1R, GCG, GCGR PTGIR 2344/4885FABP5 509/4885FABP7 687/4885
US-11332495-B2 Process for the preparation of Degarelix acetate and Degarelix acetate-mannitol premix PEPD, DNPEP, PREP PTGIR 1310/4885FABP5 4499/4885FABP7 3830/4885
US-20200392197-A1 ANTIBODY PEPTIDE CONJUGATES THAT HAVE AGONIST ACTIVITY AT BOTH THE GLUCAGON AND GLUCAGON-LIKE PEPTIDE 1 RECEPTORS GLP1R, GCG, GCGR PTGIR 2344/4885FABP5 509/4885FABP7 687/4885
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials NQO2, NQO1, NDUFA7 PTGIR 4251/4885FABP5 1182/4885FABP7 1540/4885
US-20210094984-A1 Process for the preparation of Degarelix acetate and Degarelix acetate-mannitol premix PEPD, DNPEP, PREP PTGIR 1276/4885FABP5 4521/4885FABP7 3879/4885
US-10800826-B2 Antibody peptide conjugates that have agonist activity at both the glucagon and glucagon-like peptide 1 receptors GLP1R, GCG, GCGR PTGIR 2344/4885FABP5 509/4885FABP7 687/4885
US-20220033443-A1 PROCESS FOR THE MANUFACTURE OF DEGARELIX AND ITS INTERMEDIATES ANPEP, DNPEP, NPPA PTGIR 1734/4885FABP5 4016/4885FABP7 3762/4885
US-10683334-B2 Aqueously soluble and chemically stable glucagon peptides IAPP, GLP1R, GCG PTGIR 879/4885FABP5 1228/4885FABP7 523/4885
US-12098218-B2 Process for the manufacture of degarelix and its intermediates ANPEP, DNPEP, NPPA PTGIR 1734/4885FABP5 4016/4885FABP7 3762/4885

“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.