SCHEMBL29433607

SCHEMBL29433607

COCCn1c(=O)sc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@@H]4CNCCCO4)cc3)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSC P53634 20/20 1.00
KCNH2 Q12809 3/20 0.81

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
SCHEMBL16932303 1.00 CTSC (1.00) CTSCKCNH2
SCHEMBL26117461 1.00 CTSC (1.00) CTSCKCNH2
SCHEMBL20162056 0.90 CTSC (1.00) CTSCKCNH2
SCHEMBL29433600 0.90 CTSC (1.00) CTSCKCNH2
SCHEMBL16932314 0.90 CTSC (1.00) CTSCKCNH2
SCHEMBL25180815 0.86 CTSC (1.00) CTSCKCNH2
SCHEMBL29433632 0.86 CTSC (1.00) CTSCKCNH2
SCHEMBL16932359 0.86 CTSC (1.00) CTSCKCNH2
SCHEMBL1499210 0.84 CTSC (0.72) CTSCKCNH2
SCHEMBL2072745 0.84 CTSC (0.72) CTSCKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4479059-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING HIDRADENITIS SUPPURATIVA Insmed Incorporated (US) 2024-12-25 EP claimed
CN-118695864-A Specific N- (1-cyano-2-phenethyl) -1, 4-oxaazepane-2-carboxamide for the treatment of hidradenitis suppurativa 英斯梅德股份有限公司 2024-09-24 CN claimed
EP-4423071-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CHRONIC RHINOSINUSITIS Insmed Incorporated (US) 2024-09-04 EP claimed
CN-118159525-A Specific N- (1-cyano-2-phenethyl) -1, 4-oxaazepane-2-carboxamides for the treatment of chronic sinusitis 英斯梅德股份有限公司 2024-06-07 CN claimed
EP-4329767-A1 CERTAIN-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CYSTIC FIBROSIS Insmed Incorporated (US) 2024-03-06 EP claimed
US-11773069-B2 Certain (2s)-n-[(1s)-1-cyano-2-phenylethyl]-1,4-oxazepane-2-carboxamides as dipeptidyl peptidase 1 inhibitors ASTRAZENECA AB (SE) 2023-10-03 US claimed
WO-2023159120-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING HIDRADENITIS SUPPURATIVA INSMED INCORPORATED (US) 2023-08-24 WO claimed
CN-116157687-A Methods for extracting neutrophil serine protease and treating dipeptidyl peptidase 1 mediated disorders 英斯梅德股份有限公司 2023-05-23 CN claimed
WO-2023076615-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CHRONIC RHINOSINUSITIS INSMED INCORPORATED (US) 2023-05-04 WO claimed
WO-2022232573-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CYSTIC FIBROSIS INSMED INCORPORATED (US) 2022-11-03 WO claimed
WO-2022232420-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CANCER INSMED INCORPORATED (US) 2022-11-03 WO claimed
WO-2022140516-A1 CERTAIN (25)-IV-[(LS')~ I-C YAN0-2-PHENYLETHYL·]- 1,4-OXAZEPANE-2- CARBOXAMIDES FOR TREATING BEHCET'S DISEASE INSMED INCORPORATED (US) 2022-06-30 WO claimed
EP-4479059-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING HIDRADENITIS SUPPURATIVA Insmed Incorporated (US) 2024-12-25 EP disclosed
CN-118695864-A Specific N- (1-cyano-2-phenethyl) -1, 4-oxaazepane-2-carboxamide for the treatment of hidradenitis suppurativa 英斯梅德股份有限公司 2024-09-24 CN disclosed
CN-118416078-A Pharmaceutical composition 阿斯利康(瑞典)有限公司 2024-08-02 CN disclosed
CN-118416077-A Pharmaceutical composition 阿斯利康(瑞典)有限公司 2024-08-02 CN disclosed
WO-2022232573-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CYSTIC FIBROSIS INSMED INCORPORATED (US) 2022-11-03 WO disclosed
WO-2022232420-A1 CERTAIN N-(1-CYANO-2-PHENYLETHYL)-1,4-OXAZEPANE-2-CARBOXAMIDES FOR TREATING CANCER INSMED INCORPORATED (US) 2022-11-03 WO disclosed
WO-2022140516-A1 CERTAIN (25)-IV-[(LS')~ I-C YAN0-2-PHENYLETHYL·]- 1,4-OXAZEPANE-2- CARBOXAMIDES FOR TREATING BEHCET'S DISEASE INSMED INCORPORATED (US) 2022-06-30 WO disclosed
WO-2022053019-A1 METHODS FOR TREATING METASTASIS WITH CATHEPSIN C INHIBITORS Shanghai Institute of nutrition and health, Chinese Academy of Sciences (CN) 2022-03-17 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 (1 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-11773069-B2 Certain (2s)-n-[(1s)-1-cyano-2-phenylethyl]-1,4-oxazepane-2-carboxamides as dipeptidyl peptidase 1 inhibitors DPP4, DPP7, DPEP1 CTSC 7/4885KCNH2 2475/4885

“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.