SCHEMBL29494169

SCHEMBL29494169

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 2/20 0.60
▸ TFPI P10646 1/20 0.57
▸ VIPR1 P32241 3/20 0.56
▸ VIPR2 P41587 4/20 0.55
▸ OPRM1 P35372 1/20 0.55
▸ OPRD1 P41143 1/20 0.55
▸ OPRK1 P41145 1/20 0.55
▸ ECE1 P42892 1/20 0.54
▸ GLP1R P43220 1/20 0.54
▸ MUS81 Q96NY9 1/20 0.54
▸ PTH1R Q03431 1/20 0.54
▸ NPY1R P25929 2/20 0.53
▸ NPY2R P49146 2/20 0.53
▸ NPY4R P50391 2/20 0.53
▸ NPY5R Q15761 2/20 0.53

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
SCHEMBL30512795 0.95 KISS1R (0.62) KISS1RTFPIVIPR1VIPR2OPRM1
SCHEMBL29746772 0.94 KISS1R (0.60) KISS1RTFPIVIPR1VIPR2OPRM1
SCHEMBL29746858 0.93 PTH1R (0.60) TFPIVIPR1VIPR2GLP1RPTH1R
SCHEMBL29475317 0.93 OPRM1 (0.58) KISS1RTFPIOPRM1OPRD1OPRK1
SCHEMBL29475318 0.93 OPRM1 (0.58) KISS1RTFPIOPRM1OPRD1OPRK1
SCHEMBL6437697 0.92 TFPI (0.63) KISS1RTFPIVIPR1VIPR2ECE1
SCHEMBL6437703 0.92 TFPI (0.63) KISS1RTFPIVIPR1VIPR2ECE1
SCHEMBL30553847 0.92 TFPI (0.58) KISS1RTFPIOPRM1OPRD1OPRK1
SCHEMBL30367254 0.91 TFPI (0.59) TFPIVIPR1VIPR2GLP1RPTH1R
SCHEMBL29353526 0.91 TFPI (0.59) TFPIVIPR1VIPR2GLP1RPTH1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12351561-B2 Crystalline (2S,4R)-5-(5'-chloro-2'-fluoro-[1,1'-biphenyl]-4-yl)-2-(ethoxymethyl)-4-(3-hydroxyisoxazole-5-carboxamido)-2-methylpentanoic acid and uses thereof THERAVANCE BIOPHARMA R&D IP, LLC (US) 2025-07-08 — — US disclosed
US-20240327360-A1 CRYSTALLINE (2S,4R)-5-(5'-CHLORO-2'-FLUORO-[1,1'-BIPHENYL]-4-YL)-2-(ETHOXYMETHYL)-4-(3-HYDROXYISOXAZOLE-5-CARBOXAMIDO)-2-METHYLPENTANOIC ACID AND USES THEREOF THERAVANCE BIOPHARMA R&D IP LLC (US) 2024-10-03 — — US disclosed
US-12016835-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2024-06-25 — — US disclosed
US-11919888-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2024-03-05 — — US disclosed
US-11851443-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-12-26 — — US disclosed
US-20230312537-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-10-05 — — US disclosed
US-20230285340-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-09-14 — — US disclosed
US-11718591-B2 Crystalline (2S,4R)-5-(5′-chloro-2′-fluoro-[1,1′-biphenyl]-4-yl)-2-(ethoxymethyl)-4-(3-hydroxyisoxazole-5-carboxamido)-2- methylpentanoic acid and uses thereof THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-08 — — US disclosed
US-11642332-B2 (2R,4R)-5-(5′-chloro-2′-fluorobiphenyl-4-yl)-2-hydroxy-4-[(5-methyloxazole-2-carbonyl)amino]pentanoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-05-09 — — US disclosed
US-11634413-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-04-25 — — US disclosed
US-11547687-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-01-10 — — US disclosed
US-20220298173-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-09-22 — — US disclosed
US-20220242836-A1 CRYSTALLINE (2S,4R)-5-(5'-CHLORO-2'-FLUORO-[1,1'-BIPHENYL]-4-YL)-2-(ETHOXYMETHYL)-4-(3-HYDROXYISOXAZOLE-5-CARBOXAMIDO)-2-METHYLPENTANOIC ACID AND USES THEREOF THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-08-04 — — US disclosed
EP-3256446-B1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID AS NEPRILYSIN INHIBITOR THERAVANCE BIOPHARMA R&D IP LLC (US) 2022-05-18 — — EP disclosed
EP-3099668-B1 5-BIPHENYL-4-HETEROARYLCARBONYLAMINO-PENTANOIC ACID DERIVATIVES AS NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2022-05-04 — — EP disclosed
US-20220106300-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-04-07 — — US disclosed
US-11261197-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-03-01 — — 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 (15 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-20230285340-A1 NEPRILYSIN INHIBITORS MME, REN, ACE KISS1R 1562/4885TFPI 189/4885VIPR1 184/4885
US-11718591-B2 Crystalline (2S,4R)-5-(5′-chloro-2′-fluoro-[1,1′-biphenyl]-4-yl)-2-(ethoxymethyl)-4-(3-hydroxyisoxazole-5-carboxamido)-2- methylpentanoic acid and uses thereof MME, CTSC, REN KISS1R 4296/4885TFPI 402/4885VIPR1 814/4885
US-11547687-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 1562/4885TFPI 189/4885VIPR1 184/4885
US-12351561-B2 Crystalline (2S,4R)-5-(5'-chloro-2'-fluoro-[1,1'-biphenyl]-4-yl)-2-(ethoxymethyl)-4-(3-hydroxyisoxazole-5-carboxamido)-2-methylpentanoic acid and uses thereof MME, CTSC, REN KISS1R 4287/4885TFPI 378/4885VIPR1 736/4885
US-20220242836-A1 CRYSTALLINE (2S,4R)-5-(5'-CHLORO-2'-FLUORO-[1,1'-BIPHENYL]-4-YL)-2-(ETHOXYMETHYL)-4-(3-HYDROXYISOXAZOLE-5-CARBOXAMIDO)-2-METHYLPENTANOIC ACID AND USES THEREOF MME, CTSC, REN KISS1R 4287/4885TFPI 378/4885VIPR1 736/4885
US-20240327360-A1 CRYSTALLINE (2S,4R)-5-(5'-CHLORO-2'-FLUORO-[1,1'-BIPHENYL]-4-YL)-2-(ETHOXYMETHYL)-4-(3-HYDROXYISOXAZOLE-5-CARBOXAMIDO)-2-METHYLPENTANOIC ACID AND USES THEREOF MME, CTSC, REN KISS1R 4287/4885TFPI 378/4885VIPR1 736/4885
US-11261197-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 1496/4885TFPI 187/4885VIPR1 144/4885
US-20220106300-A1 NEPRILYSIN INHIBITORS MME, REN, ACE KISS1R 2153/4885TFPI 184/4885VIPR1 128/4885
US-11634413-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 2153/4885TFPI 184/4885VIPR1 128/4885
US-20230312537-A1 NEPRILYSIN INHIBITORS MME, REN, ACE KISS1R 2153/4885TFPI 184/4885VIPR1 128/4885
US-20220298173-A1 NEPRILYSIN INHIBITORS MME, REN, ACE KISS1R 1396/4885TFPI 197/4885VIPR1 160/4885
US-11851443-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 1496/4885TFPI 187/4885VIPR1 144/4885
US-12016835-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 1562/4885TFPI 189/4885VIPR1 184/4885
US-11642332-B2 (2R,4R)-5-(5′-chloro-2′-fluorobiphenyl-4-yl)-2-hydroxy-4-[(5-methyloxazole-2-carbonyl)amino]pentanoic acid MME, DNPEP, TMPRSS15 KISS1R 4380/4885TFPI 651/4885VIPR1 1569/4885
US-11919888-B2 Neprilysin inhibitors MME, REN, ACE KISS1R 2153/4885TFPI 184/4885VIPR1 128/4885

“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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