SCHEMBL2097928

SCHEMBL2097928

[O]COc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.45
GPR84 Q9NQS5 1/20 0.41
CYP3A4 P08684 2/20 0.36
MAPK1 P28482 1/20 0.36
FABP3 P05413 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
HTR2A P28223 5/20 0.33
HTR2C P28335 5/20 0.33
CLCN2 P51788 3/20 0.32
CHRM4 P08173 1/20 0.32
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TP53 P04637 2/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
ABCC3 O15438 1/20 0.32
PLIN1 O60240 1/20 0.32
LMNA P02545 1/20 0.32
GSTA1 P08263 1/20 0.32
GSTP1 P09211 1/20 0.32

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
SCHEMBL2094955 0.80 MRGPRX4 (0.49) MRGPRX4CYP3A4TDP1ALDH1A1TP53
SCHEMBL243080 0.77 MRGPRX4 (0.41) MRGPRX4GPR84CYP3A4MAPK1FABP3
SCHEMBL2097932 0.77 MRGPRX4 (0.45) MRGPRX4GPR84CYP3A4MAPK1FABP3
SCHEMBL12300309 0.77 L3MBTL1 (0.42) MRGPRX4GPR84MAPK1HTR2AHTR2C
SCHEMBL11880335 0.77 MRGPRX4 (0.41) MRGPRX4GPR84CYP3A4MAPK1FABP3
SCHEMBL7228434 0.76 GPR84 (0.47) MRGPRX4GPR84CYP3A4MAPK1TDP1
SCHEMBL3955799 0.75 MRGPRX4 (0.48) MRGPRX4GPR84FABP3TDP1ALDH1A1
SCHEMBL3050910 0.75 TDP1 (0.61) MRGPRX4TDP1ALDH1A1TP53TSHR
SCHEMBL28826984 0.74 CSNK2A1 (0.51) MRGPRX4GPR84MAPK1HTR2AHTR2C
SCHEMBL10359843 0.74 CYP3A4 (0.47) MRGPRX4GPR84CYP3A4MAPK1TDP1

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 MRGPRX4 2959/4885GPR84 372/4885CYP3A4 1734/4885

“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.