SCHEMBL2093418

SCHEMBL2093418

FC(F)(F)C(F)(F)Oc1ccc(NC2CC[N]CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 1/20 0.37
GALR1 P47211 1/20 0.37
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
EPHX2 P34913 5/20 0.35
EPHX1 P07099 4/20 0.35
SYK P43405 2/20 0.35
ALDH1A1 P00352 1/20 0.33
GABBR2 O75899 1/20 0.33
GABBR1 Q9UBS5 1/20 0.33
ABL1 P00519 2/20 0.33
ROCK2 O75116 1/20 0.33
MAPT P10636 2/20 0.32
DHODH Q02127 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 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
SCHEMBL2093841 0.88 GALR2 (0.46) GALR2GALR1CTSLCTSBCTSS
SCHEMBL2098450 0.83 GALR2 (0.40) GALR2GALR1CTSLCTSBCTSS
SCHEMBL2091162 0.76 HTR6 (0.34) CTSSCTSKALDH1A1MAPTMEN1
SCHEMBL3121134 0.76 ALDH1A1 (0.49) GALR2GALR1CTSLCTSBCTSS
SCHEMBL2089051 0.76 CTSS (0.43) CTSSCTSKEPHX2GABBR2GABBR1
SCHEMBL2172826 0.75 EPHX2 (0.51) GALR2GALR1CTSLCTSBCTSS
SCHEMBL2091909 0.74 DDB1 (0.40) EPHX2ALDH1A1MAPTNPC1TSHR
SCHEMBL6426191 0.73 CHRM4 (0.41) EPHX2EPHX1ALDH1A1ABL1MAPT
SCHEMBL5543554 0.73 ALDH1A1 (0.38) EPHX2EPHX1ALDH1A1ABL1MAPT
SCHEMBL2090237 0.73 HTR2A (0.40) CTSLCTSBCTSSCTSKEPHX1

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 GALR2 1641/4885GALR1 1561/4885CTSL 3040/4885

“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.