SCHEMBL2094640

SCHEMBL2094640

[CH2]Cc1coc2c(Cl)cccc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 5/20 0.42
PSMB8 P28062 2/20 0.42
AHR P35869 3/20 0.40
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 2/20 0.38
NR4A2 P43354 2/20 0.35
TTR P02766 3/20 0.33
PNMT P11086 1/20 0.31
CTRC Q99895 1/20 0.31
CYP2A13 Q16696 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL20765804 0.83 PSMB5 (0.46) PSMB5PSMB8AHRCYP1A2CYP2A6
SCHEMBL20765731 0.81 PSMB5 (0.42) PSMB5PSMB8AHRCYP1A2CYP2A6
SCHEMBL2091348 0.80 PSMB5 (0.38) PSMB5PSMB8AHRCYP1A2CYP2A6
SCHEMBL2089807 0.78 PSMB5 (0.42) PSMB5PSMB8
SCHEMBL28161335 0.78 PSMB5 (0.42) PSMB5PSMB8CYP1A2CYP2A6
SCHEMBL10394749 0.77 PSMB5 (0.43) PSMB5PSMB8AHRCYP1A2CYP2A6
SCHEMBL7568303 0.76 SMN1; SMN2 (0.55) PSMB5PSMB8TTR
SCHEMBL2091325 0.75 CYP1A2 (0.42) PSMB5PSMB8AHRCYP1A2CYP2A6
SCHEMBL11622080 0.74 MAOB (0.56) PSMB5PSMB8TTRCTRC
SCHEMBL10394688 0.73 PSMB5 (0.42) PSMB5PSMB8NR4A2TTRHTR2A

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 7 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
CN-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN 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
CN-1878777-A 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2006-12-13 CN 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 PSMB5 1739/4885PSMB8 2818/4885AHR 1050/4885

“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.