Levoketoconazole

Levoketoconazole

SCHEMBL3144078

CC(=O)N1CCN(c2ccc(OC[C@H]3CO[C@](Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1.Cl

nearest known ligand 0.99

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP11A1CYP11B1CYP11B2CYP17A1ERG11

The experimentally established mechanism targets of Levoketoconazole. 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
CYP17A1 known ✓ P05093 15/20 0.99
CYP11B1 known ✓ P15538 14/20 0.99
CYP11B2 known ✓ P19099 1/20 0.99
CYP3A4 P08684 19/20 0.99
CYP21A2 P08686 16/20 0.99
CYP19A1 P11511 16/20 0.99
USP2 O75604 2/20 0.99
MAPT P10636 2/20 0.99
MAPK1 P28482 2/20 0.99
SMN1; SMN2 Q16637 2/20 0.99
TDP1 Q9NUW8 2/20 0.99
MEN1 O00255 1/20 0.99
SLC22A1 O15245 1/20 0.99
ABCC4 O15439 1/20 0.99
CYP27B1 O15528 1/20 0.99
CYP26A1 O43174 1/20 0.99
NR1I2 O75469 1/20 0.99
GMNN O75496 1/20 0.99
ABCB11 O95342 1/20 0.99
ALDH1A1 P00352 1/20 0.99

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
Levoketoconazole SCHEMBL11213838 1.00 CYP3A4 (0.99) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Ketoconazole SCHEMBL11213836 1.00 CYP3A4 (0.99) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL13575830 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Ketoconazole SCHEMBL8408 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL29588034 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL24312989 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL1517472 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Ketoconazole SCHEMBL18258319 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL41473 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1
Levoketoconazole SCHEMBL8407 0.99 CYP3A4 (1.00) CYP3A4CYP21A2CYP19A1CYP17A1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114886839-B Naftifine ketoconazole gel composition and preparation method thereof 上海博悦生物科技有限公司 2023-05-09 CN disclosed
CN-114886839-A Naftifine ketoconazole gel composition and preparation method thereof 上海博悦生物科技有限公司 2022-08-12 CN disclosed
CN-106715463-B Glycated peptide compositions and uses thereof 苏塞克斯研究实验室 2020-10-16 CN disclosed
CN-111743879-A Compositions and methods for ophthalmic and/or other applications 卡拉制药公司 2020-10-09 CN disclosed
CN-111743878-A Compositions and methods for ophthalmic and/or other applications 卡拉制药公司 2020-10-09 CN disclosed
US-9308203-B2 Pressure sensitive adhesive matrix device or system for the treatment or prevention of onychomycosis or tinea pedis TAIWAN BIOTECH CO., LTD. (TW) 2016-04-12 US disclosed
US-20100081669-A1 PRESSURE SENSITIVE ADHESIVE MATRIX DEVICE OR SYSTEM FOR THE TREATMENT OR PREVENTION OF ONYCHOMYCOSIS OR TINEA PEDIS TAIWAN BIOTECH CO., LTD. (TW) 2010-04-01 US disclosed
EP-0586106-B1 Skin care compositions containing imidazoles and retinoids JOHNSON & JOHNSON CONSUMER (US) 1997-01-22 EP disclosed
US-5583136-A STABILIZING SYSTEM OF CHELATING AGENT AND OIL SOLUBLE ANTIOXIDANT WHICH IS ALSO PRESENT IN WATER PHASE JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) 1996-12-10 US disclosed
EP-0586106-A1 Skin care compositions containing imidazoles and retinoids JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) 1994-03-09 EP disclosed