SCHEMBL2091258

SCHEMBL2091258

[CH2]C=Cc1cc(C)c(O)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 14/20 0.57
▸ PTGS2 P35354 14/20 0.57
▸ ALOX5 P09917 12/20 0.57
▸ CYP2C9 P11712 2/20 0.57
▸ CYP1A2 P05177 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ CYP2D6 P10635 1/20 0.57
▸ CYP2B6 P20813 1/20 0.57
▸ TTR P02766 1/20 0.57

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
SCHEMBL2091256 1.00 PTGS1 (0.57) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL1824103 0.85 PTGS1 (0.74) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL1824102 0.85 PTGS1 (0.74) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL27449908 0.80 TUBB1 (0.47) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL14992949 0.78 PTGS1 (0.59) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL14992948 0.78 PTGS1 (0.59) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL13357357 0.76 ALOX5 (0.59) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL21758872 0.76 PTGS1 (0.63) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL220820 0.75 PTGS1 (0.50) PTGS1PTGS2ALOX5CYP2C9CYP1A2
SCHEMBL3847709 0.75 PTGS2 (0.42) PTGS1PTGS2ALOX5CYP2C9CYP1A2

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 PTGS1 2872/4885PTGS2 1591/4885ALOX5 2338/4885

“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.

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