SCHEMBL2094861

SCHEMBL2094861

[CH2]Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 10/20 0.61
▸ CALM1 P0DP23 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PPARG P37231 3/20 0.46
▸ PPARA Q07869 3/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ SRD5A2 P31213 1/20 0.46
▸ IDH1 O75874 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.42
▸ PLA2G10 O15496 1/20 0.42
▸ PLA2G2A P14555 1/20 0.42

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
SCHEMBL2092571 0.80 CALM1 (0.50) LTA4HCALM1HRH1SRD5A2IDH1
SCHEMBL7178244 0.80 LTA4H (0.67) LTA4HCALM1L3MBTL1PPARGPPARA
SCHEMBL10607135 0.80 LTA4H (0.67) LTA4HCALM1L3MBTL1PPARGPPARA
SCHEMBL246373 0.80 LTA4H (0.67) LTA4HCALM1L3MBTL1PPARGPPARA
SCHEMBL8094422 0.79 CALM1 (0.92) LTA4HCALM1CYP2C9IDH1PLA2G10
SCHEMBL972712 0.79 CALM1 (0.92) LTA4HCALM1CYP2C9IDH1PLA2G10
SCHEMBL10269397 0.78 SRD5A2 (0.68) LTA4HCALM1L3MBTL1SRD5A2IDH1
SCHEMBL2085641 0.77 LMNA (0.67) LTA4HL3MBTL1CYP1A2CYP2C19SRD5A2
SCHEMBL2091073 0.77 LTA4H (0.60) LTA4HCALM1L3MBTL1CYP1A2CYP2D6
SCHEMBL9356877 0.76 LTA4H (0.61) LTA4HCALM1L3MBTL1PPARGPPARA

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 LTA4H 3093/4885CALM1 3356/4885L3MBTL1 2575/4885

“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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