Delafloxacin

Delafloxacin

SCHEMBL29379152

Nc1nc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

gyrAgyrBparCparE

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.86
▸ CYP2C9 P11712 2/20 0.86
▸ ALDH1A1 P00352 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ OPRM1 P35372 1/20 0.49
▸ OPRD1 P41143 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.42
▸ EPHA2 P29317 1/20 0.42
▸ FLT4 P35916 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ RARB P10826 1/20 0.42
▸ TBXAS1 P24557 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ TOP2A P11388 12/20 0.40
▸ TOP2B Q02880 10/20 0.40
▸ TOP1 P11387 2/20 0.40
▸ LMNA P02545 1/20 0.40

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
Delafloxacin SCHEMBL294694 1.00 CYP3A4 (0.86) CYP3A4CYP2C9ALDH1A1POLBCHRM2
Delafloxacin SCHEMBL29356726 1.00 CYP3A4 (0.86) CYP3A4CYP2C9ALDH1A1POLBCHRM2
Delafloxacin SCHEMBL29631821 0.99 CYP3A4 (0.85) CYP3A4CYP2C9ALDH1A1POLBCHRM2
Delafloxacin SCHEMBL441203 0.99 CYP3A4 (0.85) CYP3A4CYP2C9ALDH1A1POLBCHRM2
Delafloxacin SCHEMBL7248671 0.96 CYP3A4 (0.82) CYP3A4CYP2C9ALDH1A1POLBCHRM2
SCHEMBL30626293 0.93 CYP3A4 (0.78) CYP3A4CYP2C9ALDH1A1POLBCHRM2
SCHEMBL29080648 0.93 CYP3A4 (0.78) CYP3A4CYP2C9ALDH1A1POLBCHRM2
SCHEMBL29080643 0.93 CYP3A4 (0.78) CYP3A4CYP2C9ALDH1A1POLBCHRM2
SCHEMBL30626258 0.93 CYP3A4 (0.78) CYP3A4CYP2C9ALDH1A1POLBCHRM2
SCHEMBL30593852 0.93 CYP3A4 (0.75) CYP3A4CYP2C9ALDH1A1POLBCHRM2

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
EP-3957632-A1 MEGLUMINE SALT AND CRYSTALLINE FORMS THEREOF OF A DRUG (DELAFLOXACIN) AbbVie Inc. (US) 2022-02-23 — — EP claimed
CN-116514775-B New crystal form of meglumine salt of DELASHANXIA and preparation method thereof 安徽普利药业有限公司 2024-11-29 — — CN disclosed
US-12138257-B2 Antimicrobial compositions MELINTA SUBSIDIARY CORP. (US) 2024-11-12 — — US disclosed
US-20240307368-A1 ANTIMICROBIAL COMPOSITIONS MELINTA THERAPEUTICS, INC. 2024-09-19 — — US disclosed
US-20240165100-A1 METHODS OF TREATING INFECTIONS IN OVERWEIGHT AND OBESE PATIENTS USING ANTIBIOTICS MELINTA SUBSIDIARY CORP. 2024-05-23 — — US disclosed
CN-114831955-B Use of a pharmaceutical composition for the preparation of a medicament for the treatment, prevention or reduction of the risk of a bacterial infection 梅琳塔有限责任公司 2024-03-12 — — CN disclosed
CN-117185995-A 3, 5-difluoropyridine-2, 6-diamine derivative, preparation method and preparation method of 3, 5-difluoropyridine-2, 6-diamine 上海凌凯医药科技有限公司 2023-12-08 — — CN disclosed
CN-116514775-A New crystal form of meglumine salt of DELASHANXIA and preparation method thereof 海南普利制药股份有限公司 2023-08-01 — — CN disclosed
CN-107778293-B Improved preparation method of delafloxacin 鲁南制药集团股份有限公司 2023-06-16 — — CN disclosed
CN-114031607-B Refining method of delafloxacin and intermediate thereof 海南普利制药股份有限公司 2023-01-10 — — CN disclosed
US-20220265636-A1 ANTIMICROBIAL COMPOSITIONS MELINTA SUBSIDIARY CORP. 2022-08-25 — — US disclosed
CN-114831955-A Use of a pharmaceutical composition for the manufacture of a medicament for treating, preventing, or reducing the risk of bacterial infection 梅琳塔有限责任公司 2022-08-02 — — CN disclosed
CN-106572982-B9 Antimicrobial compositions with effervescent agents 梅琳塔有限责任公司 2022-07-08 — — CN disclosed
CN-106572982-B Antimicrobial compositions with effervescent agents 梅琳塔有限责任公司 2022-06-03 — — CN disclosed
CN-114539213-A Fluoroquinolone compound and preparation method and application thereof 广东工业大学 2022-05-27 — — CN disclosed
EP-3957632-A1 MEGLUMINE SALT AND CRYSTALLINE FORMS THEREOF OF A DRUG (DELAFLOXACIN) AbbVie Inc. (US) 2022-02-23 — — EP disclosed
CN-114031607-A Refining method of delafloxacin and intermediate thereof 海南普利制药股份有限公司 2022-02-11 — — 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 (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-20220265636-A1 ANTIMICROBIAL COMPOSITIONS NOD2, QPCT, IFNG CYP3A4 545/4885CYP2C9 402/4885ALDH1A1 2608/4885
US-20240307368-A1 ANTIMICROBIAL COMPOSITIONS NOD2, QPCT, IFNG CYP3A4 545/4885CYP2C9 402/4885ALDH1A1 2608/4885
US-20240165100-A1 METHODS OF TREATING INFECTIONS IN OVERWEIGHT AND OBESE PATIENTS USING ANTIBIOTICS CLPP, MGAM, MMP8 CYP3A4 2192/4885CYP2C9 1889/4885ALDH1A1 2778/4885
US-12138257-B2 Antimicrobial compositions NOD2, QPCT, IFNG CYP3A4 545/4885CYP2C9 402/4885ALDH1A1 2608/4885

“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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