SCHEMBL21241267

SCHEMBL21241267

CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)CCC(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 5/20 0.49
▸ ACE P12821 1/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ PAX8 Q06710 1/20 0.49
▸ MMEL1 Q495T6 3/20 0.46
▸ NPSR1 Q6W5P4 5/20 0.45
▸ MAPT P10636 3/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL21221264 0.93 MME (0.59) MMEACETDP1PAX8MMEL1
SCHEMBL21221262 0.93 MME (0.59) MMEACETDP1PAX8MMEL1
SCHEMBL21241434 0.90 MME (0.52) MMEACEMMEL1
SCHEMBL22398885 0.90 MME (0.52) MMEACEMMEL1
SCHEMBL18575929 0.83 MME (0.60) MMEACEMMEL1
SCHEMBL17164911 0.83 MME (0.60) MMEACEMMEL1
SCHEMBL1231410 0.82 MME (0.54) MMEACEMMEL1
SCHEMBL18576747 0.82 MME (0.54) MMEACEMMEL1
SCHEMBL597498 0.82 MME (0.54) MMEACEMMEL1
SCHEMBL21572792 0.82 MME (0.54) MMEACEMMEL1

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-11426375-B2 Substituted bisphenyl butanoic ester derivatives as NEP inhibitors NOVARTIS AG (CH) 2022-08-30 — — US disclosed
US-20200246295-A1 SUBSTITUTED BISPHENYL BUTANOIC ESTER DERIVATIVES AS NEP INHIBITORS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (CN) 2020-08-06 — — US disclosed
US-10668035-B2 Substituted bisphenyl butanoic ester derivatives as NEP inhibitors NOVARTIS AG (CH) 2020-06-02 — — US disclosed
WO-2019154416-A1 SUBSTITUTED BISPHENYL BUTANOIC ESTER DERIVATIVES AS NEP INHIBITORS NOVARTIS AG (CH) 2019-08-15 — — WO disclosed
US-20190240177-A1 SUBSTITUTED BISPHENYL BUTANOIC ESTER DERIVATIVES AS NEP INHIBITORS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (CN) 2019-08-08 — — 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 (4 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-11426375-B2 Substituted bisphenyl butanoic ester derivatives as NEP inhibitors MME, REN, ECE1 MME 1/4885ACE 4/4885TDP1 642/4885
US-10668035-B2 Substituted bisphenyl butanoic ester derivatives as NEP inhibitors MME, REN, ECE1 MME 1/4885ACE 4/4885TDP1 642/4885
US-20200246295-A1 SUBSTITUTED BISPHENYL BUTANOIC ESTER DERIVATIVES AS NEP INHIBITORS MME, REN, ECE1 MME 1/4885ACE 4/4885TDP1 642/4885
US-20190240177-A1 SUBSTITUTED BISPHENYL BUTANOIC ESTER DERIVATIVES AS NEP INHIBITORS MME, REN, ECE1 MME 1/4885ACE 4/4885TDP1 642/4885

“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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