SCHEMBL2092876

SCHEMBL2092876

Cc1cc(C)c(C[O])cn1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.46
NOS3 P29474 1/20 0.45
NOS1 P29475 1/20 0.45
NOS2 P35228 1/20 0.45
SLC6A4 P31645 16/20 0.36
SLC6A2 P23975 15/20 0.36
SLC6A3 Q01959 13/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
PLA2G7 Q13093 1/20 0.35
CYP2D6 P10635 2/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL7120097 0.84 NOS3 (0.63) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL30647644 0.77 UHRF1 (0.52) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL4793965 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL29707486 0.77 UHRF1 (0.52) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL317800 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL317221 0.77 UHRF1 (0.52) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL7880211 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL4793967 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL18017827 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4
SCHEMBL25652162 0.77 UHRF1 (0.46) UHRF1NOS3NOS1NOS2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 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-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 UHRF1 2531/4885NOS3 1031/4885NOS1 882/4885

“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.