SCHEMBL740135

SCHEMBL740135

CC(C)(C)OC(=O)N[C@@H](CC(=O)O)Cc1ccc(Br)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.59
CTSK P43235 6/20 0.59
ATM Q13315 1/20 0.55
CACNA1B Q00975 1/20 0.47
APP P05067 4/20 0.46
AAK1 Q2M2I8 3/20 0.46
CTSB P07858 2/20 0.44
CTSL P07711 1/20 0.44
MME P08473 1/20 0.44
POLB P06746 1/20 0.44
ITGB3 P05106 1/20 0.43
ITGA2B P08514 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
SCHEMBL740136 1.00 CTSS (0.59) CTSSCTSKATMCACNA1BAPP
SCHEMBL2617247 1.00 CTSS (0.59) CTSSCTSKATMCACNA1BAPP
SCHEMBL16942400 0.90 CTSS (0.56) CTSSCTSKATMCACNA1BAPP
SCHEMBL29163523 0.88 ATM (0.56) CTSSCTSKATMAPPCTSB
SCHEMBL1519889 0.88 ATM (0.56) CTSSCTSKATMAPPCTSB
SCHEMBL28132845 0.88 ATM (0.60) CTSSCTSKATMAPPCTSB
SCHEMBL7897952 0.88 ATM (0.56) CTSSCTSKATMAPPCTSB
SCHEMBL489489 0.88 ATM (0.70) CTSSCTSKATMAPPCTSB
SCHEMBL1519945 0.88 ATM (0.70) CTSSCTSKATMAPPCTSB
SCHEMBL489490 0.88 ATM (0.70) CTSSCTSKATMAPPCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591542-A ADAR1 small molecule inhibitor, pharmaceutical composition and application thereof 深圳市新樾生物科技有限公司 2025-03-11 CN disclosed
CN-117486762-A Novel compound and use method and application thereof 中国医学科学院医药生物技术研究所 2024-02-02 CN 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
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-10112963-B2 Substituted bisphenyl butanoic phosphonic acid derivatives as NEP inhibitors NOVARTIS AG (CH) 2018-10-30 US disclosed
US-20180193338-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 US disclosed
EP-2956464-B1 SUBSTITUTED BISPHENYL BUTANOIC PHOSPHONIC ACID DERIVATIVES AS NEP (NEUTRAL ENDOPEPTIDASE) INHIBITORS NOVARTIS AG (CH) 2018-03-28 EP disclosed
US-9839639-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-12 US disclosed
US-9839639-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-12 US disclosed
US-20170189399-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-07-06 US disclosed
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-17 US disclosed
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-17 US disclosed
US-8138168-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-20 US disclosed
US-8138168-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-20 US disclosed
US-8138168-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-20 US disclosed
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors NOVARTIS AG (CH) 2010-12-02 US disclosed
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors NOVARTIS AG (CH) 2010-12-02 US disclosed
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors NOVARTIS AG (CH) 2010-12-02 US disclosed
WO-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 WO disclosed
WO-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 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 (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-10112963-B2 Substituted bisphenyl butanoic phosphonic acid derivatives as NEP inhibitors MME, REN, ENPP1 CTSS 1824/4885CTSK 2924/4885ATM 4819/4885
US-20180193338-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CTSS 98/4885CTSK 182/4885ATM 4866/4885
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors MME, AGTR1, REN CTSS 730/4885CTSK 1421/4885ATM 4747/4885
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY REN, SERPINB1, MME CTSS 88/4885CTSK 179/4885ATM 4052/4885
US-20170189399-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CTSS 98/4885CTSK 182/4885ATM 4866/4885

“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.