SCHEMBL20215871

SCHEMBL20215871

COC(=O)[C@@H]1CC(N=[N+]=[N-])CN1C(=O)OC(C)(C)C

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 3/20 0.70
▸ ANPEP P15144 3/20 0.70
▸ CYP1A2 P05177 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ NR1H2 P55055 2/20 0.37
▸ NR1H3 Q13133 1/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ DPP4 P27487 3/20 0.34
▸ DPP8 Q6V1X1 3/20 0.34
▸ DPP9 Q86TI2 3/20 0.34
▸ DPP7 Q9UHL4 3/20 0.34
▸ P2RX3 P56373 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ CHRM3 P20309 1/20 0.32
▸ HTRA1 Q92743 1/20 0.32

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
SCHEMBL13768839 1.00 MMP2 (0.70) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL13937654 1.00 MMP2 (0.70) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL13494285 1.00 MMP2 (0.70) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL15482322 1.00 MMP2 (0.70) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL13841888 1.00 MMP2 (0.70) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL19898335 0.89 MMP2 (0.54) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL13868207 0.89 MMP2 (0.54) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL25594421 0.89 MMP2 (0.54) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL26967475 0.89 MMP2 (0.54) MMP2ANPEPCYP1A2POLBCYP3A4
SCHEMBL13962503 0.88 MMP2 (0.56) MMP2ANPEPPOLBNR1H2NR1H3

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
CN-119505138-A Chiral covalent organic framework mimic enzyme catalyst and preparation method and application thereof 浙江工业大学 2025-02-25 — — CN disclosed
US-11826350-B2 Proline-based neuropeptide FF receptor modulators RESEARCH TRIANGLE INSTITUTE (US) 2023-11-28 — — US disclosed
EP-4257191-A2 HETEROCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2023-10-11 — — EP disclosed
EP-3472149-B1 HETEROCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2023-08-30 — — EP disclosed
US-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION MISSION THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
US-11377439-B2 Heterocyclic prolinamide derivatives Orion Ophthalmology LLC (US) 2022-07-05 — — US disclosed
EP-3472130-B1 ALIPHATIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2022-02-16 — — EP disclosed
US-10730832-B2 Aliphatic prolinamide derivatives Orion Ophthalmology LLC (US) 2020-08-04 — — US disclosed
US-20200030287-A1 PROLINE-BASED NEUROPEPTIDE FF RECEPTOR MODULATORS RESEARCH TRIANGLE INSTITUTE 2020-01-30 — — US disclosed
US-20190330146-A1 ALIPHATIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2019-10-31 — — US disclosed
US-20190322645-A1 HETEROCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2019-10-24 — — US disclosed
US-10428080-B2 TBK/IKK inhibitor compounds and uses thereof MERCK PATENT GMBH (DE) 2019-10-01 — — US disclosed
US-9988391-B2 TBK/IKK inhibitor compounds and uses thereof MERCK PATENT GMBH (DE) 2018-06-05 — — US disclosed
CN-101602795-B Cyclohexalipopeptide amine antifungal compound, salts and preparation method thereof ARMY MEDICAL UNIV. NO.2, CHINESE PLA (CN) 2011-12-21 — — CN disclosed
US-20110251403-A1 Method for Manufacturing Hydroxyl Group Substitution Product CENTRAL GLASS COMPANY, LIMITED (JP) 2011-10-13 — — US disclosed
US-20110251403-A1 Method for Manufacturing Hydroxyl Group Substitution Product CENTRAL GLASS COMPANY, LIMITED (JP) 2011-10-13 — — US disclosed
CN-101602795-A Cyclohexalipopeptideamine amine antifungal compound and its esters and preparation method UNIV PLA 2ND MILITARY MEDICAL (CN) 2009-12-16 — — 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 (9 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-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION USP30, UQCRC1, NDUFAF1 MMP2 2616/4885ANPEP 2234/4885CYP1A2 2209/4885
US-10428080-B2 TBK/IKK inhibitor compounds and uses thereof NFKBIA, TBKBP1, TBK1 MMP2 4573/4885ANPEP 4168/4885CYP1A2 3277/4885
US-10730832-B2 Aliphatic prolinamide derivatives HTRA1, ALDH1A2, PREP MMP2 145/4885ANPEP 95/4885CYP1A2 2015/4885
US-20200030287-A1 PROLINE-BASED NEUROPEPTIDE FF RECEPTOR MODULATORS NPFFR1, NPFFR2, NPBWR1 MMP2 2459/4885ANPEP 93/4885CYP1A2 4337/4885
US-20190322645-A1 HETEROCYCLIC PROLINAMIDE DERIVATIVES HTRA1, ALDH1A2, HTRA2 MMP2 145/4885ANPEP 279/4885CYP1A2 1804/4885
US-20190330146-A1 ALIPHATIC PROLINAMIDE DERIVATIVES HTRA1, ALDH1A2, PREP MMP2 145/4885ANPEP 95/4885CYP1A2 2015/4885
US-11826350-B2 Proline-based neuropeptide FF receptor modulators NPFFR1, NPFFR2, NPBWR1 MMP2 2459/4885ANPEP 93/4885CYP1A2 4337/4885
US-11377439-B2 Heterocyclic prolinamide derivatives HTRA1, ALDH1A2, HTRA2 MMP2 145/4885ANPEP 279/4885CYP1A2 1804/4885
US-20110251403-A1 Method for Manufacturing Hydroxyl Group Substitution Product PHF2, XDH, YIF1A MMP2 1058/4885ANPEP 355/4885CYP1A2 362/4885

“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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