Oxacillin

Oxacillin

SCHEMBL4780815

Cc1onc(-c2ccccc2)c1C(=O)NC1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

mecApbp2pbp4pbpApbpF

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

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.85
SMN1; SMN2 Q16637 1/20 0.85
ABCB11 O95342 4/20 0.79
CYP1A2 P05177 1/20 0.74
HPGD P15428 3/20 0.66
LMNA P02545 3/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
TDP1 Q9NUW8 2/20 0.66
SLCO1B3 Q9NPD5 1/20 0.65
SLCO1B1 Q9Y6L6 1/20 0.65
PTGS1 P23219 1/20 0.60
PDE3A Q14432 1/20 0.60
HRH1 P35367 1/20 0.55
SLC22A8 Q8TCC7 1/20 0.55
CYP2C19 P33261 1/20 0.55
KDM4E B2RXH2 1/20 0.53
RECQL P46063 1/20 0.53

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
Oxacillin SCHEMBL3817 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL8722495 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL9876911 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL18048119 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL15387553 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL14126543 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL8724789 1.00 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL41164 0.99 ALDH1A1 (0.83) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL28965117 0.99 ALDH1A1 (0.83) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD
Oxacillin SCHEMBL28938009 0.99 ALDH1A1 (0.83) ALDH1A1SMN1; SMN2ABCB11CYP1A2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1143950-B1 TOPICAL APPLICATION PRODUCTS AGAINST ONYCHOMYCOSES BIOEQUAL AG (CH) 2005-03-09 EP claimed
US-20180059082-A1 MATERIALS AND METHODS FOR THE DETECTION OF TRACE AMOUNTS OF SUBSTANCES IN BIOLOGICAL AND ENVIRONMENTAL SAMPLES THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2018-03-01 US disclosed
EP-1680076-B1 PHARMACEUTICAL AND COSMETIC FORMULATIONS FOR TREATING FINGERNAILS BIOEQUAL AG (CH) 2008-07-02 EP disclosed
WO-2008049401-A2 NAIL VARNISH FOR COSMETIC AND MEDICAL APPLICATIONS SUSILO RUDY (DE) 2008-05-02 WO disclosed
US-20070166249-A1 Pharmaceutical and cosmetic formulations for treating fingernails BIOEQUAL AG (CH) 2007-07-19 US disclosed
EP-1680076-A1 PHARMACEUTICAL AND COSMETIC FORMULATIONS FOR TREATING FINGERNAILS BioEqual AG (CH) 2006-07-19 EP disclosed
EP-1143950-B1 TOPICAL APPLICATION PRODUCTS AGAINST ONYCHOMYCOSES BIOEQUAL AG (CH) 2005-03-09 EP disclosed
WO-2005018585-A1 PHARMACEUTICAL AND COSMETIC FORMULATIONS FOR TREATING FINGERNAILS BIOEQUAL AG (CH) 2005-03-03 WO disclosed
US-6740326-B1 WATER-FREE TOPICAL APPLICATION COMPOSITION FOR TREATMENT OF NAIL DISEASES AND NAIL CARE CONSISTING OF ANTIMYCOTIC AGENT AND LOWER ALKYL ESTER OF LACTIC ACID, MALIC ACID, TARTARIC ACID OR CITRIC ACID AS PENETRATION PROMOTING CARRIER BIOEQUAL AG (CH) 2004-05-25 US disclosed