SCHEMBL4639637

SCHEMBL4639637

CCOC(=O)[C@H](C)CCN

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.54
CPB2 Q96IY4 2/20 0.46
CYP1A2 P05177 1/20 0.43
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 3/20 0.40
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
GABBR2 O75899 2/20 0.37
GABBR1 Q9UBS5 2/20 0.37
HPGD P15428 1/20 0.36
MEN1 O00255 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
SCHEMBL7879761 1.00 GABRR1 (0.54) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL30360217 0.98 GABRR1 (0.52) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL28212354 0.98 GABRR1 (0.52) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL28212355 0.98 GABRR1 (0.52) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL9411898 0.87 CPB2 (0.51) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL14616914 0.85 ALDH1A1 (0.48) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL16125818 0.85 CPB2 (0.59) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL518315 0.85 CPB2 (0.59) GABRR1CPB2CYP1A2ALOX15ALDH1A1
Hydrochloric Acid SCHEMBL28252625 0.85 CPB2 (0.50) GABRR1CPB2CYP1A2ALOX15ALDH1A1
SCHEMBL9343926 0.84 ALDH1A1 (0.42) GABRR1CPB2CYP1A2ALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240115536-A1 DUAL-ACTING PHARMACEUTICAL COMPOSITIONS BASED ON SUPERSTRUCTURES OF ANGIOTENSIN RECEPTOR ANTAGONIST/BLOCKER (ARB) AND NEUTRAL ENDOPEPTIDASE (NEP) INHIBITOR NOVARTIS AG (CH) 2024-04-11 US claimed
EP-3943084-A1 NEP INHIBITORS FOR TREATING DISEASES CHARACTERIZED BY ATRIAL ENLARGEMENT OR REMODELING Novartis AG (CH) 2022-01-26 EP claimed
CN-108685889-A Nep inhibitor for treating the disease for being characterized as atrial enlargement or reconstruct 诺华股份有限公司 2018-10-23 CN claimed
CN-101516831-B Process for preparing biaryl substituted 4-amino-butyric acid or derivatives thereof and their use in production of NEP inhibitors NOVARTIS AG 2013-12-25 CN claimed
CN-102091330-A Pharmaceutical compositions comprising valsartan and NEP inhibitors NOVARTIS AG 2011-06-15 CN claimed
EP-1951309-A2 COMBINATION OF AN ANGIOTENSIN II RECEPTOR BLOCKER, A CALCIUM CHANNEL BLOCKER AND ANOTHER ACTIVE AGENT Novartis AG (CH) 2008-08-06 EP claimed
WO-2007056324-A2 COMBINATION OF AN ANGIOTENSIN II RECEPTOR BLOCKER, A CALCIUM CHANNEL BLOCKER AND ANOTHER ACTIVE AGENT NOVARTIS AG (CH) 2007-05-18 WO claimed
CN-1615134-A Pharmaceutical composition comprising valsartan and NEP inhibitor NOVARTIS AG (CH) 2005-05-11 CN claimed
US-20250339395-A1 COMPOUNDS CONTAINING S-N-VALERYL-N-{[2'-(1H-TETRAZOLE-5-YL)-BIPHENYL-4-YL]-METHYL}-VALINE AND (2R,4S)-5-BIPHENYL-4-YL-4-(3-CARBOXY-PROPIONYLAMINO)-2-METHYL-PENTANOIC ACID ETHYL ESTER MOIETIES AND CATIONS NOVARTIS PHARMACEUTICALS CORP (US) 2025-11-06 US disclosed
US-20250325518-A1 USE OF A COMBINATION OF SACUBITRIL AND VALSARTAN NOVARTIS AG (CH) 2025-10-23 US disclosed
EP-4609912-A2 NEW USE OF A COMBINATION OF SACUBITRIL AND VALSARTAN Novartis AG (CH) 2025-09-03 EP disclosed
EP-4570314-A2 SACUBITRIL-VALSARTAN DOSAGE REGIMEN FOR TREATING CHRONIC SYSTOLIC HEART FAILURE Novartis AG (CH) 2025-06-18 EP disclosed
EP-3411021-B1 NEW USE OF A COMBINATION OF SACUBITRIL AND VALSARTAN NOVARTIS AG (CH) 2025-05-14 EP disclosed
EP-4212152-B1 SACUBITRIL-VALSARTAN DOSAGE REGIMEN FOR TREATING CHRONIC SYSTOLIC HEART FAILURE NOVARTIS AG (CH) 2025-04-30 EP disclosed
WO-2010136474-A2 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS NOVARTIS AG (CH) 2010-12-02 WO disclosed
CN-101848700-A Dual action pharmaceutical composition based on a superstructure of angiotensin receptor antagonists/blockers (ARBs) and Neutral Endopeptidase (NEP) inhibitors NOVARTIS AG 2010-09-29 CN disclosed
CN-101631765-A Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG 2010-01-20 CN disclosed
CN-101516831-A Process for preparing biaryl substituted 4-amino-butyric acid or derivatives thereof and their use in the production of NEP inhibitors NOVARTIS AG (CH) 2009-08-26 CN disclosed
CN-101151027-A Combination of organic compounds NOVARTIS AG (CH) 2008-03-26 CN disclosed
CN-1615134-A Pharmaceutical composition comprising valsartan and NEP inhibitor NOVARTIS AG (CH) 2005-05-11 CN 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 (3 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-20240115536-A1 DUAL-ACTING PHARMACEUTICAL COMPOSITIONS BASED ON SUPERSTRUCTURES OF ANGIOTENSIN RECEPTOR ANTAGONIST/BLOCKER (ARB) AND NEUTRAL ENDOPEPTIDASE (NEP) INHIBITOR ACE, MME, AGTR1 GABRR1 1848/4885CPB2 768/4885CYP1A2 1478/4885
US-20250325518-A1 USE OF A COMBINATION OF SACUBITRIL AND VALSARTAN MME, ACE, REN GABRR1 1731/4885CPB2 422/4885CYP1A2 1635/4885
US-20250339395-A1 COMPOUNDS CONTAINING S-N-VALERYL-N-{[2'-(1H-TETRAZOLE-5-YL)-BIPHENYL-4-YL]-METHYL}-VALINE AND (2R,4S)-5-BIPHENYL-4-YL-4-(3-CARBOXY-PROPIONYLAMINO)-2-METHYL-PENTANOIC ACID ETHYL ESTER MOIETIES AND CATIONS MME, DNPEP, ANPEP GABRR1 2256/4885CPB2 384/4885CYP1A2 2883/4885

“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.