Vaborbactam

Vaborbactam

SCHEMBL620289

O=C(O)C[C@@H]1CC[C@H](NC(=O)Cc2cccs2)B(O)O1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

KPC-2

The experimentally established mechanism targets of Vaborbactam. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.45
▸ POLB P06746 6/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ HPGD P15428 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ TSHR P16473 2/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ PKM P14618 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ XBP1 P17861 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
Vaborbactam SCHEMBL18967758 1.00 SIGMAR1 (0.45) SIGMAR1POLBHSD17B10HPGDALDH1A1
Vaborbactam SCHEMBL622398 1.00 SIGMAR1 (0.45) SIGMAR1POLBHSD17B10HPGDALDH1A1
Vaborbactam SCHEMBL22726486 1.00 SIGMAR1 (0.45) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL10189424 0.93 POLB (0.48) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL621552 0.93 POLB (0.48) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL10189422 0.93 POLB (0.48) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL21700157 0.93 POLB (0.48) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL10158857 0.90 CYP3A4 (0.45) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL10158855 0.90 CYP3A4 (0.45) SIGMAR1POLBHSD17B10HPGDALDH1A1
SCHEMBL22096721 0.89 SIGMAR1 (0.42) SIGMAR1POLBHSD17B10HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4039257-B1 PHARMACEUTICAL COMPOSITION AND KIT CONTAINING A PENAM DERIVATIVE OR SALT THEREOF AND ONE OR MORE COMPOUNDS SELECTED FROM BETA-LACTAMASE INHIBITOR COMPOUND, ANTIBACTERIAL COMPOUND AND SALTS OF THESE FUJIFILM CORP (JP) 2026-05-27 — — EP claimed
WO-2026104587-A1 CYCLIC BORONIC ACID ESTERS USEFUL AS ADJUVANTS IN THE TREATMENT OF BACTERIAL INFECTIONS ADJUTEC PHARMA AS (NO) 2026-05-21 — — WO claimed
EP-4739326-A2 PRODUCTION & SECRETION OF AUXIN-LIKE MOLECULES IN BACTERIA SNIPR Biome ApS (DK) 2026-05-13 — — EP claimed
US-12622919-B2 Methods for treating hypervirulent Klebsiella pneumoniae infection CITY UNIVERSITY OF HONG KONG (CN) 2026-05-12 — — US claimed
US-20260115234-A1 PRODUCTION & SECRETION OF AUXIN-LIKE MOLECULES IN BACTERIA SNIPR BIOME APS (DK) 2026-04-30 — — US claimed
WO-2026089982-A1 CRYSTALLINE FORMS OF A MONOBACTAM MERCK SHARP & DOHME LLC (US) 2026-04-30 — — WO claimed
WO-2026089981-A1 PHARMACEUTICAL COMPOSITION COMPRISING A MONOBACTAM AND A SOLUBILIZER MERCK SHARP & DOHME LLC (US) 2026-04-30 — — WO claimed
US-20260103765-A1 METHODS AND COMPOSITIONS FOR RAPID PATHOGEN DETECTION THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2026-04-16 — — US claimed
US-20260102374-A1 METHODS OF TREATING BACTERIAL INFECTIONS MELINTA SUBSIDIARY CORP (US) 2026-04-16 — — US claimed
EP-3475441-B1 METHODS, SYSTEMS AND/OR KITS FOR DETECTING ANTIMICROBIAL RESISTANCE IN BACTERIA BECTON DICKINSON CO (US) 2026-03-25 — — EP claimed
US-11376237-B2 Methods of treating bacterial infections MELINTA SUBSIDIARY CORP. (US) 2022-07-05 — — US claimed
EP-4007759-A1 BETA-LACTAM COMPOUNDS, THEIR PREPARATION AND USE AS ANTIBACTERIAL AGENTS Ningxia Academy of Agriculture and Forestry Sciences (CN) 2022-06-08 — — EP claimed
US-20220170934-A1 ASSAYS FOR IMPROVING AUTOMATED ANTIMICROBIAL SUSCEPTIBILITY TESTING ACCURACY OXFORD FINANCE LLC 2022-06-02 — — US claimed
US-11286512-B2 Compositions, methods, systems and/or kits for detecting antimicrobial resistance in bacteria BECTON, DICKINSON AND COMPANY (US) 2022-03-29 — — US claimed
EP-3969461-A1 HOMODIMERIC TOBRAMYCIN ADJUVANT REPURPOSES NOVOBIOCIN AS AN EFFECTIVE ANTIBACTERIAL AGENT AGAINST GRAM-NEGATIVE BACTERIA University of Manitoba (CA) 2022-03-23 — — EP claimed
US-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS THE SCRIPPS RESEARCH INSTITUTE 2022-01-27 — — US claimed
EP-3666778-B1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF MELINTA THERAPEUTICS INC (US) 2021-11-10 — — EP claimed
EP-3666778-A1 A CRYSTALLINE CYCLIC BORONIC ACID ESTER DERIVATIVE, METHOD FOR THE PREPARATION AND THERAPEUTIC USES THEREOF Rempex Pharmaceuticals, Inc. (US) 2020-06-17 — — EP claimed
US-9687497-B1 Salts and polymorphs of cyclic boronic acid ester derivatives and therapeutic uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2017-06-27 — — US claimed
US-20170173055-A1 SALTS AND POLYMORPHS OF CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF MELINTA SUBSIDIARY CORP. 2017-06-22 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-20260115234-A1 PRODUCTION & SECRETION OF AUXIN-LIKE MOLECULES IN BACTERIA AADAT, NAT1, IDO1 SIGMAR1 2554/4885POLB 1072/4885HSD17B10 764/4885
US-20260103765-A1 METHODS AND COMPOSITIONS FOR RAPID PATHOGEN DETECTION RPAP1, RNGTT, CLPP SIGMAR1 3401/4885POLB 33/4885HSD17B10 3456/4885
US-11376237-B2 Methods of treating bacterial infections BCL6B, BCL6, BCL9 SIGMAR1 3570/4885POLB 1945/4885HSD17B10 3237/4885
US-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS PCSK9, PCSK7, PCSK6 SIGMAR1 4472/4885POLB 1446/4885HSD17B10 216/4885
US-20260102374-A1 METHODS OF TREATING BACTERIAL INFECTIONS MYD88, MCL1, BCL6B SIGMAR1 2404/4885POLB 3700/4885HSD17B10 4771/4885
US-20170173055-A1 SALTS AND POLYMORPHS OF CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF SLC10A2, SLC10A1, BBC3 SIGMAR1 1421/4885POLB 2557/4885HSD17B10 1038/4885
US-12622919-B2 Methods for treating hypervirulent Klebsiella pneumoniae infection STAT4, STAT1, PKM SIGMAR1 1801/4885POLB 1557/4885HSD17B10 3843/4885

“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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