SCHEMBL2090466

SCHEMBL2090466

CN(C([O])=O)c1c(Cl)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
ALDH1A1 P00352 2/20 0.41
S1PR4 O95977 1/20 0.41
HTT P42858 1/20 0.40
TSHR P16473 2/20 0.38
AKR1B1 P15121 1/20 0.38
HPGD P15428 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
FSCN1 Q16658 1/20 0.36
TP53 P04637 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
NOTUM Q6P988 1/20 0.34

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
SCHEMBL30132112 0.83 FSCN1 (0.48) POLBALDH1A1S1PR4HTTTSHR
SCHEMBL2090468 0.83 POLB (0.47) POLBALDH1A1S1PR4HTTTSHR
SCHEMBL12763813 0.81 POLB (0.42) POLBALDH1A1S1PR4HTTTSHR
SCHEMBL2089844 0.78 FSCN1 (0.44) POLBALDH1A1S1PR4TSHRHPGD
SCHEMBL23723677 0.78 HTT (0.44) POLBALDH1A1HTTAKR1B1TP53
SCHEMBL2093311 0.78 TSHR (0.42) POLBALDH1A1HTTTSHRFSCN1
SCHEMBL2097563 0.77 GPBAR1 (0.47) POLBALDH1A1TSHRHPGDCES2
SCHEMBL2089199 0.76 MAPT (0.41) POLBALDH1A1S1PR4TSHRHPGD
SCHEMBL23723535 0.76 HTT (0.42) POLBALDH1A1S1PR4HTTTSHR
SCHEMBL2792862 0.76 POLB (0.39) POLBALDH1A1S1PR4HTTKMT2A

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
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

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 POLB 757/4885ALDH1A1 412/4885S1PR4 2394/4885

“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.