Isavuconazole

Isavuconazole

SCHEMBL21665461

C[C@@H](c1nc(-c2ccc(C#N)cc2)cs1)C(O)(Cn1cncn1)c1cc(F)ccc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 1.00
CYP3A4 P08684 15/20 0.88
KCNH2 Q12809 3/20 0.88
CYP2C19 P33261 13/20 0.52
CYP2C9 P11712 12/20 0.52
CYP1A2 P05177 6/20 0.52
CYP2D6 P10635 6/20 0.52
LMNA P02545 2/20 0.46
CYP2B6 P20813 1/20 0.46
CYP3A5 P20815 1/20 0.46
CYP3A7 P24462 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP3A43 Q9HB55 1/20 0.46
CYP46A1 Q9Y6A2 1/20 0.46
CYP19A1 P11511 3/20 0.41
HSP90AA1 P07900 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ADRA1A P35348 1/20 0.41
CYP51A1 Q16850 1/20 0.41

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
Isavuconazole SCHEMBL939036 1.00 ABCG2 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Isavuconazole SCHEMBL31454343 1.00 ABCG2 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Isavuconazole SCHEMBL13649107 1.00 ABCG2 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Isavuconazole SCHEMBL939038 1.00 ABCG2 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Isavuconazole SCHEMBL30524137 1.00 ABCG2 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Isavuconazole SCHEMBL30586603 0.99 ABCG2 (0.98) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Ravuconazole SCHEMBL13169577 0.94 CYP3A4 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Ravuconazole SCHEMBL939025 0.94 CYP3A4 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Ravuconazole SCHEMBL939026 0.94 CYP3A4 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9
Ravuconazole SCHEMBL30994710 0.94 CYP3A4 (1.00) ABCG2CYP3A4KCNH2CYP2C19CYP2C9

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023148544-A1 CRYSTALLINE FORM OF ISAVUCONAZONIUM SULFATE AND A PROCESS FOR ITS PREPARATION GLENMARK LIFE SCIENCES LIMITED (IN) 2023-08-10 WO disclosed
WO-2023148544-A1 CRYSTALLINE FORM OF ISAVUCONAZONIUM SULFATE AND A PROCESS FOR ITS PREPARATION GLENMARK LIFE SCIENCES LIMITED (IN) 2023-08-10 WO disclosed
US-20210299044-A1 SYSTEMS AND METHODS FOR DELIVERY OF DRUGS AND OTHER SUBSTANCES COMPRISING DEEP EUTECTIC SOLVENTS Novilla Pharmaceuticals, Inc. (US) 2021-09-30 US disclosed
WO-2021037597-A1 ISAVUCONAZONIUM SALTS AND PROCESS FOR PREPARING THEREOF SYNTHON B.V. (NL) 2021-03-04 WO disclosed
CN-107778306-B Isaconazole compound and preparation method thereof 江苏奥赛康药业有限公司 2020-10-16 CN disclosed
WO-2020028471-A1 SYSTEMS AND METHODS FOR DELIVERY OF DRUGS AND OTHER SUBSTANCES COMPRISING DEEP EUTECTIC SOLVENTS BULLSEYETX LLC (US) 2020-02-06 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-20210299044-A1 SYSTEMS AND METHODS FOR DELIVERY OF DRUGS AND OTHER SUBSTANCES COMPRISING DEEP EUTECTIC SOLVENTS PTGES, PTGER3, PTGES3 ABCG2 4/4885CYP3A4 845/4885KCNH2 2322/4885

“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.